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madgpap/Target_Publications

Created October 12, 2014 19:00
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find the number of publications related to a ChEMBL target
Raw
Target_Publications
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"cells": [
{
"cell_type": "code",
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"input": [
"import pandas as pd"
],
"language": "python",
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"prompt_number": 53
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"cell_type": "code",
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"input": [
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"input": [
"## First WS call with a UniProt ID to get the target ChEMBL ID.\n",
"r = requests.get(\"https://www.ebi.ac.uk/chemblws/targets/uniprot/Q13936.json\")"
],
"language": "python",
"metadata": {},
"outputs": [],
"prompt_number": 55
},
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"cell_type": "code",
"collapsed": false,
"input": [
"r.ok"
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"language": "python",
"metadata": {},
"outputs": [
{
"metadata": {},
"output_type": "pyout",
"prompt_number": 56,
"text": [
"True"
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}
],
"prompt_number": 56
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"r.json()['target']"
],
"language": "python",
"metadata": {},
"outputs": [
{
"metadata": {},
"output_type": "pyout",
"prompt_number": 57,
"text": [
"{u'bioactivityCount': 254,\n",
" u'chemblId': u'CHEMBL1940',\n",
" u'compoundCount': 186,\n",
" u'description': u'Voltage-gated L-type calcium channel alpha-1C subunit',\n",
" u'geneNames': u'Unspecified',\n",
" u'organism': u'Homo sapiens',\n",
" u'preferredName': u'Voltage-gated L-type calcium channel alpha-1C subunit',\n",
" u'proteinAccession': u'Q13936',\n",
" u'synonyms': u'CCHL1A1,CACNL1A1,Calcium channel, L type, alpha-1 polypeptide, isoform 1, cardiac muscle,Voltage-gated calcium channel subunit alpha Cav1.2,CACNA1C,CACN2,CACH2 ,Voltage-dependent L-type calcium channel subunit alpha-1C',\n",
" u'targetType': u'SINGLE PROTEIN'}"
]
}
],
"prompt_number": 57
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"## Second WS call to get the target bioactivities and associated references.\n",
"rr = requests.get(\"https://www.ebi.ac.uk/chemblws/targets/{}/bioactivities.json\".format(r.json()['target']['chemblId']))"
],
"language": "python",
"metadata": {},
"outputs": [],
"prompt_number": 58
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"rr.ok"
],
"language": "python",
"metadata": {},
"outputs": [
{
"metadata": {},
"output_type": "pyout",
"prompt_number": 59,
"text": [
"True"
]
}
],
"prompt_number": 59
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"## Put the results in a data frame.\n",
"df = pd.DataFrame(rr.json()['bioactivities'])"
],
"language": "python",
"metadata": {},
"outputs": [],
"prompt_number": 62
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"df"
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"language": "python",
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"outputs": [
{
"html": [
"<div style=\"max-height:1000px;max-width:1500px;overflow:auto;\">\n",
"<table border=\"1\" class=\"dataframe\">\n",
" <thead>\n",
" <tr style=\"text-align: right;\">\n",
" <th></th>\n",
" <th>activity_comment</th>\n",
" <th>assay_chemblid</th>\n",
" <th>assay_description</th>\n",
" <th>assay_type</th>\n",
" <th>bioactivity_type</th>\n",
" <th>ingredient_cmpd_chemblid</th>\n",
" <th>name_in_reference</th>\n",
" <th>operator</th>\n",
" <th>organism</th>\n",
" <th>parent_cmpd_chemblid</th>\n",
" <th>reference</th>\n",
" <th>target_chemblid</th>\n",
" <th>target_confidence</th>\n",
" <th>target_name</th>\n",
" <th>units</th>\n",
" <th>value</th>\n",
" </tr>\n",
" </thead>\n",
" <tbody>\n",
" <tr>\n",
" <th>0 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL664887</td>\n",
" <td> Inhibition of [3H]nitrendipine binding to L-ty...</td>\n",
" <td> B</td>\n",
" <td> Ki</td>\n",
" <td> CHEMBL159854</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL159854</td>\n",
" <td> J. Med. Chem., (1987) 30:4:690</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 1</td>\n",
" </tr>\n",
" <tr>\n",
" <th>1 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1039575</td>\n",
" <td> Inhibition of Cav1.2 expressed in CHO cells by...</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL569185</td>\n",
" <td> 4g, KVI-020, WYE-160020</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL569185</td>\n",
" <td> J. Med. Chem., (2009) 52:21:6531</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>2 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1647979</td>\n",
" <td> Blockade of Cav1.2 channel at 10 uM by fluores...</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL1643725</td>\n",
" <td> 20</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL1643725</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2011) 21:2:869</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 70</td>\n",
" </tr>\n",
" <tr>\n",
" <th>3 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1647981</td>\n",
" <td> Blockade of Cav1.2 channel at 10 uM by fluores...</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL1643725</td>\n",
" <td> 20</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL1643725</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2011) 21:2:869</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 81</td>\n",
" </tr>\n",
" <tr>\n",
" <th>4 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1647979</td>\n",
" <td> Blockade of Cav1.2 channel at 10 uM by fluores...</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL1643735</td>\n",
" <td> 30</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL1643735</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2011) 21:2:869</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 85</td>\n",
" </tr>\n",
" <tr>\n",
" <th>5 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1001517</td>\n",
" <td> Activity at Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL522211</td>\n",
" <td> ent-1l</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL522211</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2009) 19:13:3398</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 20000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>6 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL561259</td>\n",
" <td> 1h</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL561259</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>7 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL559101</td>\n",
" <td> 1e</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL559101</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>8 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL562926</td>\n",
" <td> 3b</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL562926</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>9 </th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL557032</td>\n",
" <td> 2g</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL557032</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>10</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL551517</td>\n",
" <td> 2h</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL551517</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>11</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1001517</td>\n",
" <td> Activity at Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL495993</td>\n",
" <td> ent-1j</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL495993</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2009) 19:13:3398</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>12</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL655369</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> 4a</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 38.2</td>\n",
" </tr>\n",
" <tr>\n",
" <th>13</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL655370</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> 4a</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 7</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 60.4</td>\n",
" </tr>\n",
" <tr>\n",
" <th>14</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL659152</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> 4a</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 7</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 2.5</td>\n",
" </tr>\n",
" <tr>\n",
" <th>15</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL659153</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> 4a</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151193</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 7</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 9.2</td>\n",
" </tr>\n",
" <tr>\n",
" <th>16</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653730</td>\n",
" <td> Dissociation constant for inhibition of [3H]ni...</td>\n",
" <td> B</td>\n",
" <td> Kd1</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> 4</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 0.23</td>\n",
" </tr>\n",
" <tr>\n",
" <th>17</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653731</td>\n",
" <td> Dissociation constant for inhibition of [3H]ni...</td>\n",
" <td> B</td>\n",
" <td> Kd2</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> 4</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 85</td>\n",
" </tr>\n",
" <tr>\n",
" <th>18</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660545</td>\n",
" <td> Bmax1 from dihydropyridine receptor binding as...</td>\n",
" <td> B</td>\n",
" <td> Bmax1</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> 4</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 79</td>\n",
" </tr>\n",
" <tr>\n",
" <th>19</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660547</td>\n",
" <td> Bmax2 from dihydropyridine receptor binding as...</td>\n",
" <td> B</td>\n",
" <td> Bmax2</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> 4</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL177144</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 21</td>\n",
" </tr>\n",
" <tr>\n",
" <th>20</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL655369</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 58.2</td>\n",
" </tr>\n",
" <tr>\n",
" <th>21</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL659151</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 7</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 2.4</td>\n",
" </tr>\n",
" <tr>\n",
" <th>22</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL659152</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 7</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 10.8</td>\n",
" </tr>\n",
" <tr>\n",
" <th>23</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL659155</td>\n",
" <td> Inhibition of VGCC alpha-1C-b expressed in CHO...</td>\n",
" <td> F</td>\n",
" <td> Peak current</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL151777</td>\n",
" <td> J. Med. Chem., (1999) 42:25:5266</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 7</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 26.7</td>\n",
" </tr>\n",
" <tr>\n",
" <th>24</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653732</td>\n",
" <td> Displacement of [3H](+)-PN200-110 binding to c...</td>\n",
" <td> B</td>\n",
" <td> Ki</td>\n",
" <td> CHEMBL104082</td>\n",
" <td> 1c</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL104082</td>\n",
" <td> J. Med. Chem., (1999) 42:16:3087</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 18.2</td>\n",
" </tr>\n",
" <tr>\n",
" <th>25</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL923047</td>\n",
" <td> Displacement of [3H]diltiazem from human Cav1....</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL248195</td>\n",
" <td> 40</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL248195</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2007) 17:16:4630</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 9</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 24</td>\n",
" </tr>\n",
" <tr>\n",
" <th>26</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL923065</td>\n",
" <td> Displacement of [3H]diltiazem from human Cav1....</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL247828</td>\n",
" <td> 47</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL247828</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2007) 17:16:4630</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 9</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 3500</td>\n",
" </tr>\n",
" <tr>\n",
" <th>27</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL666481</td>\n",
" <td> Displacement of [3H]nitrendipine from dihydrop...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL23451</td>\n",
" <td> 4e</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL23451</td>\n",
" <td> J. Med. Chem., (1995) 38:1:119</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 2700</td>\n",
" </tr>\n",
" <tr>\n",
" <th>28</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660543</td>\n",
" <td> Binding affinity for DHP (Dihydropyridine) sit...</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL315548</td>\n",
" <td> 1</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL315548</td>\n",
" <td> Bioorg. Med. Chem. Lett., (1997) 7:19:2519</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 250</td>\n",
" </tr>\n",
" <tr>\n",
" <th>29</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653728</td>\n",
" <td> Inhibition of [3H]nitrendipine binding to L-ty...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL39684</td>\n",
" <td> 8l</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL39684</td>\n",
" <td> J. Med. Chem., (1990) 33:5:1510</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 2.6</td>\n",
" </tr>\n",
" <tr>\n",
" <th>30</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL666481</td>\n",
" <td> Displacement of [3H]nitrendipine from dihydrop...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL24491</td>\n",
" <td> 6e</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL24491</td>\n",
" <td> J. Med. Chem., (1995) 38:1:119</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 50000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>31</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653730</td>\n",
" <td> Dissociation constant for inhibition of [3H]ni...</td>\n",
" <td> B</td>\n",
" <td> Kd1</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 0.006</td>\n",
" </tr>\n",
" <tr>\n",
" <th>32</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653731</td>\n",
" <td> Dissociation constant for inhibition of [3H]ni...</td>\n",
" <td> B</td>\n",
" <td> Kd2</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 1</td>\n",
" </tr>\n",
" <tr>\n",
" <th>33</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660545</td>\n",
" <td> Bmax1 from dihydropyridine receptor binding as...</td>\n",
" <td> B</td>\n",
" <td> Bmax1</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 21</td>\n",
" </tr>\n",
" <tr>\n",
" <th>34</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660547</td>\n",
" <td> Bmax2 from dihydropyridine receptor binding as...</td>\n",
" <td> B</td>\n",
" <td> Bmax2</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL63997</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 79</td>\n",
" </tr>\n",
" <tr>\n",
" <th>35</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL923047</td>\n",
" <td> Displacement of [3H]diltiazem from human Cav1....</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL399232</td>\n",
" <td> 39</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL399232</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2007) 17:16:4630</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 9</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> Unspecified</td>\n",
" </tr>\n",
" <tr>\n",
" <th>36</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL923047</td>\n",
" <td> Displacement of [3H]diltiazem from human Cav1....</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL245598</td>\n",
" <td> 43</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL245598</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2007) 17:16:4630</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 9</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 19</td>\n",
" </tr>\n",
" <tr>\n",
" <th>37</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653730</td>\n",
" <td> Dissociation constant for inhibition of [3H]ni...</td>\n",
" <td> B</td>\n",
" <td> Kd1</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> 5</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 1.25</td>\n",
" </tr>\n",
" <tr>\n",
" <th>38</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660545</td>\n",
" <td> Bmax1 from dihydropyridine receptor binding as...</td>\n",
" <td> B</td>\n",
" <td> Bmax1</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> 5</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 8</td>\n",
" </tr>\n",
" <tr>\n",
" <th>39</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660547</td>\n",
" <td> Bmax2 from dihydropyridine receptor binding as...</td>\n",
" <td> B</td>\n",
" <td> Bmax2</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> 5</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> %</td>\n",
" <td> 92</td>\n",
" </tr>\n",
" <tr>\n",
" <th>40</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL687168</td>\n",
" <td> Dissociation constant for inhibition of [3H]ni...</td>\n",
" <td> B</td>\n",
" <td> Kd2</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> 5</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL172829</td>\n",
" <td> J. Med. Chem., (1988) 31:5:936</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 107</td>\n",
" </tr>\n",
" <tr>\n",
" <th>41</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL666481</td>\n",
" <td> Displacement of [3H]nitrendipine from dihydrop...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL280926</td>\n",
" <td> 4d</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL280926</td>\n",
" <td> J. Med. Chem., (1995) 38:1:119</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30</td>\n",
" </tr>\n",
" <tr>\n",
" <th>42</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653732</td>\n",
" <td> Displacement of [3H](+)-PN200-110 binding to c...</td>\n",
" <td> B</td>\n",
" <td> Ki</td>\n",
" <td> CHEMBL317651</td>\n",
" <td> 1b</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL317651</td>\n",
" <td> J. Med. Chem., (1999) 42:16:3087</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 20.2</td>\n",
" </tr>\n",
" <tr>\n",
" <th>43</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653728</td>\n",
" <td> Inhibition of [3H]nitrendipine binding to L-ty...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL290092</td>\n",
" <td> 8q</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL290092</td>\n",
" <td> J. Med. Chem., (1990) 33:5:1510</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 105</td>\n",
" </tr>\n",
" <tr>\n",
" <th>44</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL660543</td>\n",
" <td> Binding affinity for DHP (Dihydropyridine) sit...</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL315382</td>\n",
" <td> 3</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL315382</td>\n",
" <td> Bioorg. Med. Chem. Lett., (1997) 7:19:2519</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 270</td>\n",
" </tr>\n",
" <tr>\n",
" <th>45</th>\n",
" <td> Not Active</td>\n",
" <td> CHEMBL3100169</td>\n",
" <td> Inhibition of human Cav1.2 channel</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL530733</td>\n",
" <td> 12</td>\n",
" <td> Unspecified</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL530733</td>\n",
" <td> ACS Med. Chem. Lett., (2013) 4:11:1037</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 9</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> Unspecified</td>\n",
" <td> Unspecified</td>\n",
" </tr>\n",
" <tr>\n",
" <th>46</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653729</td>\n",
" <td> Inhibition of [3H]nitrendipine binding to calc...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL345843</td>\n",
" <td> 17</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL345843</td>\n",
" <td> J. Med. Chem., (1987) 30:4:635</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 488</td>\n",
" </tr>\n",
" <tr>\n",
" <th>47</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL684132</td>\n",
" <td> Inhibition of [3H]diltiazem binding to calcium...</td>\n",
" <td> F</td>\n",
" <td> Ki</td>\n",
" <td> CHEMBL345843</td>\n",
" <td> 17</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL345843</td>\n",
" <td> J. Med. Chem., (1987) 30:4:635</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 505</td>\n",
" </tr>\n",
" <tr>\n",
" <th>48</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL666481</td>\n",
" <td> Displacement of [3H]nitrendipine from dihydrop...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL23692</td>\n",
" <td> 15d</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL23692</td>\n",
" <td> J. Med. Chem., (1995) 38:1:119</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 5</td>\n",
" </tr>\n",
" <tr>\n",
" <th>49</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653728</td>\n",
" <td> Inhibition of [3H]nitrendipine binding to L-ty...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL39925</td>\n",
" <td> 8a</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL39925</td>\n",
" <td> J. Med. Chem., (1990) 33:5:1510</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 23</td>\n",
" </tr>\n",
" <tr>\n",
" <th>50</th>\n",
" <td> Not Active</td>\n",
" <td> CHEMBL660544</td>\n",
" <td> Binding affinity for DHP (Dihydropyridine) sit...</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL445837</td>\n",
" <td> 4</td>\n",
" <td> Unspecified</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL445837</td>\n",
" <td> Bioorg. Med. Chem. Lett., (1997) 7:19:2519</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> Unspecified</td>\n",
" <td> Unspecified</td>\n",
" </tr>\n",
" <tr>\n",
" <th>51</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL666481</td>\n",
" <td> Displacement of [3H]nitrendipine from dihydrop...</td>\n",
" <td> B</td>\n",
" <td> Kd</td>\n",
" <td> CHEMBL282279</td>\n",
" <td> 4a</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL282279</td>\n",
" <td> J. Med. Chem., (1995) 38:1:119</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 480</td>\n",
" </tr>\n",
" <tr>\n",
" <th>52</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL559531</td>\n",
" <td> 2c</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL559531</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>53</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL564757</td>\n",
" <td> 2e</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL564757</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 19000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>54</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL653732</td>\n",
" <td> Displacement of [3H](+)-PN200-110 binding to c...</td>\n",
" <td> B</td>\n",
" <td> Ki</td>\n",
" <td> CHEMBL107213</td>\n",
" <td> 1f</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL107213</td>\n",
" <td> J. Med. Chem., (1999) 42:16:3087</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 6</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 72.9</td>\n",
" </tr>\n",
" <tr>\n",
" <th>55</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1001517</td>\n",
" <td> Activity at Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL482637</td>\n",
" <td> ent-1i</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL482637</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2009) 19:13:3398</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>56</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL552196</td>\n",
" <td> 1f</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL552196</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>57</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL561379</td>\n",
" <td> 1g</td>\n",
" <td> &gt;</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL561379</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 30000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>58</th>\n",
" <td> Unspecified</td>\n",
" <td> CHEMBL1051709</td>\n",
" <td> Inhibition of Cav 1.2 channel</td>\n",
" <td> B</td>\n",
" <td> IC50</td>\n",
" <td> CHEMBL552402</td>\n",
" <td> 1j</td>\n",
" <td> =</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL552402</td>\n",
" <td> J. Med. Chem., (2009) 52:16:5009</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> nM</td>\n",
" <td> 12000</td>\n",
" </tr>\n",
" <tr>\n",
" <th>59</th>\n",
" <td> Not Determined</td>\n",
" <td> CHEMBL1647979</td>\n",
" <td> Blockade of Cav1.2 channel at 10 uM by fluores...</td>\n",
" <td> B</td>\n",
" <td> Inhibition</td>\n",
" <td> CHEMBL1643718</td>\n",
" <td> 13</td>\n",
" <td> Unspecified</td>\n",
" <td> Homo sapiens</td>\n",
" <td> CHEMBL1643718</td>\n",
" <td> Bioorg. Med. Chem. Lett., (2011) 21:2:869</td>\n",
" <td> CHEMBL1940</td>\n",
" <td> 8</td>\n",
" <td> Voltage-gated L-type calcium channel alpha-1C ...</td>\n",
" <td> Unspecified</td>\n",
" <td> Unspecified</td>\n",
" </tr>\n",
" <tr>\n",
" <th></th>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" <td>...</td>\n",
" </tr>\n",
" </tbody>\n",
"</table>\n",
"<p>254 rows \u00d7 16 columns</p>\n",
"</div>"
],
"metadata": {},
"output_type": "pyout",
"prompt_number": 63,
"text": [
" activity_comment assay_chemblid \\\n",
"0 Unspecified CHEMBL664887 \n",
"1 Unspecified CHEMBL1039575 \n",
"2 Unspecified CHEMBL1647979 \n",
"3 Unspecified CHEMBL1647981 \n",
"4 Unspecified CHEMBL1647979 \n",
"5 Unspecified CHEMBL1001517 \n",
"6 Unspecified CHEMBL1051709 \n",
"7 Unspecified CHEMBL1051709 \n",
"8 Unspecified CHEMBL1051709 \n",
"9 Unspecified CHEMBL1051709 \n",
"10 Unspecified CHEMBL1051709 \n",
"11 Unspecified CHEMBL1001517 \n",
"12 Unspecified CHEMBL655369 \n",
"13 Unspecified CHEMBL655370 \n",
"14 Unspecified CHEMBL659152 \n",
"15 Unspecified CHEMBL659153 \n",
"16 Unspecified CHEMBL653730 \n",
"17 Unspecified CHEMBL653731 \n",
"18 Unspecified CHEMBL660545 \n",
"19 Unspecified CHEMBL660547 \n",
"20 Unspecified CHEMBL655369 \n",
"21 Unspecified CHEMBL659151 \n",
"22 Unspecified CHEMBL659152 \n",
"23 Unspecified CHEMBL659155 \n",
"24 Unspecified CHEMBL653732 \n",
"25 Unspecified CHEMBL923047 \n",
"26 Unspecified CHEMBL923065 \n",
"27 Unspecified CHEMBL666481 \n",
"28 Unspecified CHEMBL660543 \n",
"29 Unspecified CHEMBL653728 \n",
"30 Unspecified CHEMBL666481 \n",
"31 Unspecified CHEMBL653730 \n",
"32 Unspecified CHEMBL653731 \n",
"33 Unspecified CHEMBL660545 \n",
"34 Unspecified CHEMBL660547 \n",
"35 Unspecified CHEMBL923047 \n",
"36 Unspecified CHEMBL923047 \n",
"37 Unspecified CHEMBL653730 \n",
"38 Unspecified CHEMBL660545 \n",
"39 Unspecified CHEMBL660547 \n",
"40 Unspecified CHEMBL687168 \n",
"41 Unspecified CHEMBL666481 \n",
"42 Unspecified CHEMBL653732 \n",
"43 Unspecified CHEMBL653728 \n",
"44 Unspecified CHEMBL660543 \n",
"45 Not Active CHEMBL3100169 \n",
"46 Unspecified CHEMBL653729 \n",
"47 Unspecified CHEMBL684132 \n",
"48 Unspecified CHEMBL666481 \n",
"49 Unspecified CHEMBL653728 \n",
"50 Not Active CHEMBL660544 \n",
"51 Unspecified CHEMBL666481 \n",
"52 Unspecified CHEMBL1051709 \n",
"53 Unspecified CHEMBL1051709 \n",
"54 Unspecified CHEMBL653732 \n",
"55 Unspecified CHEMBL1001517 \n",
"56 Unspecified CHEMBL1051709 \n",
"57 Unspecified CHEMBL1051709 \n",
"58 Unspecified CHEMBL1051709 \n",
"59 Not Determined CHEMBL1647979 \n",
" ... ... \n",
"\n",
" assay_description assay_type \\\n",
"0 Inhibition of [3H]nitrendipine binding to L-ty... B \n",
"1 Inhibition of Cav1.2 expressed in CHO cells by... B \n",
"2 Blockade of Cav1.2 channel at 10 uM by fluores... B \n",
"3 Blockade of Cav1.2 channel at 10 uM by fluores... B \n",
"4 Blockade of Cav1.2 channel at 10 uM by fluores... B \n",
"5 Activity at Cav 1.2 channel B \n",
"6 Inhibition of Cav 1.2 channel B \n",
"7 Inhibition of Cav 1.2 channel B \n",
"8 Inhibition of Cav 1.2 channel B \n",
"9 Inhibition of Cav 1.2 channel B \n",
"10 Inhibition of Cav 1.2 channel B \n",
"11 Activity at Cav 1.2 channel B \n",
"12 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"13 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"14 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"15 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"16 Dissociation constant for inhibition of [3H]ni... B \n",
"17 Dissociation constant for inhibition of [3H]ni... B \n",
"18 Bmax1 from dihydropyridine receptor binding as... B \n",
"19 Bmax2 from dihydropyridine receptor binding as... B \n",
"20 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"21 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"22 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"23 Inhibition of VGCC alpha-1C-b expressed in CHO... F \n",
"24 Displacement of [3H](+)-PN200-110 binding to c... B \n",
"25 Displacement of [3H]diltiazem from human Cav1.... B \n",
"26 Displacement of [3H]diltiazem from human Cav1.... B \n",
"27 Displacement of [3H]nitrendipine from dihydrop... B \n",
"28 Binding affinity for DHP (Dihydropyridine) sit... B \n",
"29 Inhibition of [3H]nitrendipine binding to L-ty... B \n",
"30 Displacement of [3H]nitrendipine from dihydrop... B \n",
"31 Dissociation constant for inhibition of [3H]ni... B \n",
"32 Dissociation constant for inhibition of [3H]ni... B \n",
"33 Bmax1 from dihydropyridine receptor binding as... B \n",
"34 Bmax2 from dihydropyridine receptor binding as... B \n",
"35 Displacement of [3H]diltiazem from human Cav1.... B \n",
"36 Displacement of [3H]diltiazem from human Cav1.... B \n",
"37 Dissociation constant for inhibition of [3H]ni... B \n",
"38 Bmax1 from dihydropyridine receptor binding as... B \n",
"39 Bmax2 from dihydropyridine receptor binding as... B \n",
"40 Dissociation constant for inhibition of [3H]ni... B \n",
"41 Displacement of [3H]nitrendipine from dihydrop... B \n",
"42 Displacement of [3H](+)-PN200-110 binding to c... B \n",
"43 Inhibition of [3H]nitrendipine binding to L-ty... B \n",
"44 Binding affinity for DHP (Dihydropyridine) sit... B \n",
"45 Inhibition of human Cav1.2 channel B \n",
"46 Inhibition of [3H]nitrendipine binding to calc... B \n",
"47 Inhibition of [3H]diltiazem binding to calcium... F \n",
"48 Displacement of [3H]nitrendipine from dihydrop... B \n",
"49 Inhibition of [3H]nitrendipine binding to L-ty... B \n",
"50 Binding affinity for DHP (Dihydropyridine) sit... B \n",
"51 Displacement of [3H]nitrendipine from dihydrop... B \n",
"52 Inhibition of Cav 1.2 channel B \n",
"53 Inhibition of Cav 1.2 channel B \n",
"54 Displacement of [3H](+)-PN200-110 binding to c... B \n",
"55 Activity at Cav 1.2 channel B \n",
"56 Inhibition of Cav 1.2 channel B \n",
"57 Inhibition of Cav 1.2 channel B \n",
"58 Inhibition of Cav 1.2 channel B \n",
"59 Blockade of Cav1.2 channel at 10 uM by fluores... B \n",
" ... ... \n",
"\n",
" bioactivity_type ingredient_cmpd_chemblid name_in_reference \\\n",
"0 Ki CHEMBL159854 3 \n",
"1 IC50 CHEMBL569185 4g, KVI-020, WYE-160020 \n",
"2 Inhibition CHEMBL1643725 20 \n",
"3 Inhibition CHEMBL1643725 20 \n",
"4 Inhibition CHEMBL1643735 30 \n",
"5 IC50 CHEMBL522211 ent-1l \n",
"6 IC50 CHEMBL561259 1h \n",
"7 IC50 CHEMBL559101 1e \n",
"8 IC50 CHEMBL562926 3b \n",
"9 IC50 CHEMBL557032 2g \n",
"10 IC50 CHEMBL551517 2h \n",
"11 IC50 CHEMBL495993 ent-1j \n",
"12 Peak current CHEMBL151193 4a \n",
"13 Peak current CHEMBL151193 4a \n",
"14 Peak current CHEMBL151193 4a \n",
"15 Peak current CHEMBL151193 4a \n",
"16 Kd1 CHEMBL177144 4 \n",
"17 Kd2 CHEMBL177144 4 \n",
"18 Bmax1 CHEMBL177144 4 \n",
"19 Bmax2 CHEMBL177144 4 \n",
"20 Peak current CHEMBL151777 3 \n",
"21 Peak current CHEMBL151777 3 \n",
"22 Peak current CHEMBL151777 3 \n",
"23 Peak current CHEMBL151777 3 \n",
"24 Ki CHEMBL104082 1c \n",
"25 Inhibition CHEMBL248195 40 \n",
"26 IC50 CHEMBL247828 47 \n",
"27 Kd CHEMBL23451 4e \n",
"28 IC50 CHEMBL315548 1 \n",
"29 Kd CHEMBL39684 8l \n",
"30 Kd CHEMBL24491 6e \n",
"31 Kd1 CHEMBL63997 3 \n",
"32 Kd2 CHEMBL63997 3 \n",
"33 Bmax1 CHEMBL63997 3 \n",
"34 Bmax2 CHEMBL63997 3 \n",
"35 Inhibition CHEMBL399232 39 \n",
"36 Inhibition CHEMBL245598 43 \n",
"37 Kd1 CHEMBL172829 5 \n",
"38 Bmax1 CHEMBL172829 5 \n",
"39 Bmax2 CHEMBL172829 5 \n",
"40 Kd2 CHEMBL172829 5 \n",
"41 Kd CHEMBL280926 4d \n",
"42 Ki CHEMBL317651 1b \n",
"43 Kd CHEMBL290092 8q \n",
"44 IC50 CHEMBL315382 3 \n",
"45 Inhibition CHEMBL530733 12 \n",
"46 Kd CHEMBL345843 17 \n",
"47 Ki CHEMBL345843 17 \n",
"48 Kd CHEMBL23692 15d \n",
"49 Kd CHEMBL39925 8a \n",
"50 IC50 CHEMBL445837 4 \n",
"51 Kd CHEMBL282279 4a \n",
"52 IC50 CHEMBL559531 2c \n",
"53 IC50 CHEMBL564757 2e \n",
"54 Ki CHEMBL107213 1f \n",
"55 IC50 CHEMBL482637 ent-1i \n",
"56 IC50 CHEMBL552196 1f \n",
"57 IC50 CHEMBL561379 1g \n",
"58 IC50 CHEMBL552402 1j \n",
"59 Inhibition CHEMBL1643718 13 \n",
" ... ... ... \n",
"\n",
" operator organism parent_cmpd_chemblid \\\n",
"0 = Homo sapiens CHEMBL159854 \n",
"1 > Homo sapiens CHEMBL569185 \n",
"2 = Homo sapiens CHEMBL1643725 \n",
"3 = Homo sapiens CHEMBL1643725 \n",
"4 = Homo sapiens CHEMBL1643735 \n",
"5 = Homo sapiens CHEMBL522211 \n",
"6 > Homo sapiens CHEMBL561259 \n",
"7 > Homo sapiens CHEMBL559101 \n",
"8 = Homo sapiens CHEMBL562926 \n",
"9 > Homo sapiens CHEMBL557032 \n",
"10 > Homo sapiens CHEMBL551517 \n",
"11 > Homo sapiens CHEMBL495993 \n",
"12 = Homo sapiens CHEMBL151193 \n",
"13 = Homo sapiens CHEMBL151193 \n",
"14 = Homo sapiens CHEMBL151193 \n",
"15 = Homo sapiens CHEMBL151193 \n",
"16 = Homo sapiens CHEMBL177144 \n",
"17 = Homo sapiens CHEMBL177144 \n",
"18 = Homo sapiens CHEMBL177144 \n",
"19 = Homo sapiens CHEMBL177144 \n",
"20 = Homo sapiens CHEMBL151777 \n",
"21 = Homo sapiens CHEMBL151777 \n",
"22 = Homo sapiens CHEMBL151777 \n",
"23 = Homo sapiens CHEMBL151777 \n",
"24 = Homo sapiens CHEMBL104082 \n",
"25 = Homo sapiens CHEMBL248195 \n",
"26 = Homo sapiens CHEMBL247828 \n",
"27 = Homo sapiens CHEMBL23451 \n",
"28 = Homo sapiens CHEMBL315548 \n",
"29 = Homo sapiens CHEMBL39684 \n",
"30 > Homo sapiens CHEMBL24491 \n",
"31 = Homo sapiens CHEMBL63997 \n",
"32 = Homo sapiens CHEMBL63997 \n",
"33 = Homo sapiens CHEMBL63997 \n",
"34 = Homo sapiens CHEMBL63997 \n",
"35 = Homo sapiens CHEMBL399232 \n",
"36 = Homo sapiens CHEMBL245598 \n",
"37 = Homo sapiens CHEMBL172829 \n",
"38 = Homo sapiens CHEMBL172829 \n",
"39 = Homo sapiens CHEMBL172829 \n",
"40 = Homo sapiens CHEMBL172829 \n",
"41 = Homo sapiens CHEMBL280926 \n",
"42 = Homo sapiens CHEMBL317651 \n",
"43 = Homo sapiens CHEMBL290092 \n",
"44 = Homo sapiens CHEMBL315382 \n",
"45 Unspecified Homo sapiens CHEMBL530733 \n",
"46 = Homo sapiens CHEMBL345843 \n",
"47 = Homo sapiens CHEMBL345843 \n",
"48 = Homo sapiens CHEMBL23692 \n",
"49 = Homo sapiens CHEMBL39925 \n",
"50 Unspecified Homo sapiens CHEMBL445837 \n",
"51 = Homo sapiens CHEMBL282279 \n",
"52 > Homo sapiens CHEMBL559531 \n",
"53 = Homo sapiens CHEMBL564757 \n",
"54 = Homo sapiens CHEMBL107213 \n",
"55 > Homo sapiens CHEMBL482637 \n",
"56 > Homo sapiens CHEMBL552196 \n",
"57 > Homo sapiens CHEMBL561379 \n",
"58 = Homo sapiens CHEMBL552402 \n",
"59 Unspecified Homo sapiens CHEMBL1643718 \n",
" ... ... ... \n",
"\n",
" reference target_chemblid \\\n",
"0 J. Med. Chem., (1987) 30:4:690 CHEMBL1940 \n",
"1 J. Med. Chem., (2009) 52:21:6531 CHEMBL1940 \n",
"2 Bioorg. Med. Chem. Lett., (2011) 21:2:869 CHEMBL1940 \n",
"3 Bioorg. Med. Chem. Lett., (2011) 21:2:869 CHEMBL1940 \n",
"4 Bioorg. Med. Chem. Lett., (2011) 21:2:869 CHEMBL1940 \n",
"5 Bioorg. Med. Chem. Lett., (2009) 19:13:3398 CHEMBL1940 \n",
"6 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"7 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"8 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"9 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"10 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"11 Bioorg. Med. Chem. Lett., (2009) 19:13:3398 CHEMBL1940 \n",
"12 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"13 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"14 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"15 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"16 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"17 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"18 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"19 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"20 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"21 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"22 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"23 J. Med. Chem., (1999) 42:25:5266 CHEMBL1940 \n",
"24 J. Med. Chem., (1999) 42:16:3087 CHEMBL1940 \n",
"25 Bioorg. Med. Chem. Lett., (2007) 17:16:4630 CHEMBL1940 \n",
"26 Bioorg. Med. Chem. Lett., (2007) 17:16:4630 CHEMBL1940 \n",
"27 J. Med. Chem., (1995) 38:1:119 CHEMBL1940 \n",
"28 Bioorg. Med. Chem. Lett., (1997) 7:19:2519 CHEMBL1940 \n",
"29 J. Med. Chem., (1990) 33:5:1510 CHEMBL1940 \n",
"30 J. Med. Chem., (1995) 38:1:119 CHEMBL1940 \n",
"31 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"32 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"33 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"34 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"35 Bioorg. Med. Chem. Lett., (2007) 17:16:4630 CHEMBL1940 \n",
"36 Bioorg. Med. Chem. Lett., (2007) 17:16:4630 CHEMBL1940 \n",
"37 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"38 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"39 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"40 J. Med. Chem., (1988) 31:5:936 CHEMBL1940 \n",
"41 J. Med. Chem., (1995) 38:1:119 CHEMBL1940 \n",
"42 J. Med. Chem., (1999) 42:16:3087 CHEMBL1940 \n",
"43 J. Med. Chem., (1990) 33:5:1510 CHEMBL1940 \n",
"44 Bioorg. Med. Chem. Lett., (1997) 7:19:2519 CHEMBL1940 \n",
"45 ACS Med. Chem. Lett., (2013) 4:11:1037 CHEMBL1940 \n",
"46 J. Med. Chem., (1987) 30:4:635 CHEMBL1940 \n",
"47 J. Med. Chem., (1987) 30:4:635 CHEMBL1940 \n",
"48 J. Med. Chem., (1995) 38:1:119 CHEMBL1940 \n",
"49 J. Med. Chem., (1990) 33:5:1510 CHEMBL1940 \n",
"50 Bioorg. Med. Chem. Lett., (1997) 7:19:2519 CHEMBL1940 \n",
"51 J. Med. Chem., (1995) 38:1:119 CHEMBL1940 \n",
"52 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"53 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"54 J. Med. Chem., (1999) 42:16:3087 CHEMBL1940 \n",
"55 Bioorg. Med. Chem. Lett., (2009) 19:13:3398 CHEMBL1940 \n",
"56 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"57 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"58 J. Med. Chem., (2009) 52:16:5009 CHEMBL1940 \n",
"59 Bioorg. Med. Chem. Lett., (2011) 21:2:869 CHEMBL1940 \n",
" ... ... \n",
"\n",
" target_confidence target_name \\\n",
"0 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"1 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"2 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"3 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"4 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"5 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"6 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"7 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"8 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"9 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"10 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"11 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"12 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"13 7 Voltage-gated L-type calcium channel alpha-1C ... \n",
"14 7 Voltage-gated L-type calcium channel alpha-1C ... \n",
"15 7 Voltage-gated L-type calcium channel alpha-1C ... \n",
"16 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"17 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"18 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"19 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"20 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"21 7 Voltage-gated L-type calcium channel alpha-1C ... \n",
"22 7 Voltage-gated L-type calcium channel alpha-1C ... \n",
"23 7 Voltage-gated L-type calcium channel alpha-1C ... \n",
"24 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"25 9 Voltage-gated L-type calcium channel alpha-1C ... \n",
"26 9 Voltage-gated L-type calcium channel alpha-1C ... \n",
"27 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"28 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"29 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"30 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"31 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"32 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"33 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"34 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"35 9 Voltage-gated L-type calcium channel alpha-1C ... \n",
"36 9 Voltage-gated L-type calcium channel alpha-1C ... \n",
"37 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"38 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"39 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"40 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"41 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"42 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"43 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"44 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"45 9 Voltage-gated L-type calcium channel alpha-1C ... \n",
"46 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"47 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"48 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"49 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"50 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"51 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"52 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"53 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"54 6 Voltage-gated L-type calcium channel alpha-1C ... \n",
"55 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"56 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"57 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"58 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
"59 8 Voltage-gated L-type calcium channel alpha-1C ... \n",
" ... ... \n",
"\n",
" units value \n",
"0 nM 1 \n",
"1 nM 30000 \n",
"2 % 70 \n",
"3 % 81 \n",
"4 % 85 \n",
"5 nM 20000 \n",
"6 nM 30000 \n",
"7 nM 30000 \n",
"8 nM 30000 \n",
"9 nM 30000 \n",
"10 nM 30000 \n",
"11 nM 30000 \n",
"12 % 38.2 \n",
"13 % 60.4 \n",
"14 % 2.5 \n",
"15 % 9.2 \n",
"16 nM 0.23 \n",
"17 nM 85 \n",
"18 % 79 \n",
"19 % 21 \n",
"20 % 58.2 \n",
"21 % 2.4 \n",
"22 % 10.8 \n",
"23 % 26.7 \n",
"24 nM 18.2 \n",
"25 % 24 \n",
"26 nM 3500 \n",
"27 nM 2700 \n",
"28 nM 250 \n",
"29 nM 2.6 \n",
"30 nM 50000 \n",
"31 nM 0.006 \n",
"32 nM 1 \n",
"33 % 21 \n",
"34 % 79 \n",
"35 % Unspecified \n",
"36 % 19 \n",
"37 nM 1.25 \n",
"38 % 8 \n",
"39 % 92 \n",
"40 nM 107 \n",
"41 nM 30 \n",
"42 nM 20.2 \n",
"43 nM 105 \n",
"44 nM 270 \n",
"45 Unspecified Unspecified \n",
"46 nM 488 \n",
"47 nM 505 \n",
"48 nM 5 \n",
"49 nM 23 \n",
"50 Unspecified Unspecified \n",
"51 nM 480 \n",
"52 nM 30000 \n",
"53 nM 19000 \n",
"54 nM 72.9 \n",
"55 nM 30000 \n",
"56 nM 30000 \n",
"57 nM 30000 \n",
"58 nM 12000 \n",
"59 Unspecified Unspecified \n",
" ... ... \n",
"\n",
"[254 rows x 16 columns]"
]
}
],
"prompt_number": 63
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"r.close()\n",
"rr.close()"
],
"language": "python",
"metadata": {},
"outputs": [],
"prompt_number": 65
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"## Find the number of distinct publications for this target:\n",
"number_of_publications = len(set(df['reference']))"
],
"language": "python",
"metadata": {},
"outputs": [],
"prompt_number": 66
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"number_of_publications"
],
"language": "python",
"metadata": {},
"outputs": [
{
"metadata": {},
"output_type": "pyout",
"prompt_number": 67,
"text": [
"38"
]
}
],
"prompt_number": 67
},
{
"cell_type": "code",
"collapsed": false,
"input": [
"## Publications:\n",
"sorted(list(set(df['reference'])))"
],
"language": "python",
"metadata": {},
"outputs": [
{
"metadata": {},
"output_type": "pyout",
"prompt_number": 70,
"text": [
"[u'ACS Med. Chem. Lett., (2013) 4:11:1037',\n",
" u'ACS Med. Chem. Lett., (2013) 4:2:293',\n",
" u'Bioorg. Med. Chem. Lett., (1997) 7:19:2519',\n",
" u'Bioorg. Med. Chem. Lett., (2007) 17:16:4630',\n",
" u'Bioorg. Med. Chem. Lett., (2009) 19:13:3398',\n",
" u'Bioorg. Med. Chem. Lett., (2010) 20:24:7479',\n",
" u'Bioorg. Med. Chem. Lett., (2011) 21:11:3390',\n",
" u'Bioorg. Med. Chem. Lett., (2011) 21:13:3970',\n",
" u'Bioorg. Med. Chem. Lett., (2011) 21:2:869',\n",
" u'Bioorg. Med. Chem. Lett., (2011) 21:6:1692',\n",
" u'Bioorg. Med. Chem. Lett., (2011) 21:9:2646',\n",
" u'Bioorg. Med. Chem. Lett., (2012) 22:12:3941',\n",
" u'Bioorg. Med. Chem. Lett., (2012) 22:21:6671',\n",
" u'Bioorg. Med. Chem. Lett., (2013) 23:12:3584',\n",
" u'Bioorg. Med. Chem. Lett., (2013) 23:17:4979',\n",
" u'Bioorg. Med. Chem. Lett., (2013) 23:19:5361',\n",
" u'Bioorg. Med. Chem. Lett., (2013) 23:1:119',\n",
" u'Bioorg. Med. Chem. Lett., (2013) 23:21:5829',\n",
" u'Bioorg. Med. Chem. Lett., (2014) 24:3:880',\n",
" u'J. Med. Chem., (1987) 30:4:635',\n",
" u'J. Med. Chem., (1987) 30:4:690',\n",
" u'J. Med. Chem., (1988) 31:5:936',\n",
" u'J. Med. Chem., (1990) 33:5:1510',\n",
" u'J. Med. Chem., (1990) 33:8:2255',\n",
" u'J. Med. Chem., (1993) 36:4:439',\n",
" u'J. Med. Chem., (1995) 38:1:119',\n",
" u'J. Med. Chem., (1999) 42:16:3087',\n",
" u'J. Med. Chem., (1999) 42:25:5266',\n",
" u'J. Med. Chem., (2008) 51:20:6471',\n",
" u'J. Med. Chem., (2009) 52:16:5009',\n",
" u'J. Med. Chem., (2009) 52:21:6531',\n",
" u'J. Med. Chem., (2011) 54:21:7477',\n",
" u'J. Med. Chem., (2012) 55:11:5361',\n",
" u'J. Med. Chem., (2012) 55:22:10229',\n",
" u'J. Med. Chem., (2012) 55:22:9847',\n",
" u'J. Med. Chem., (2012) 55:7:2945',\n",
" u'J. Med. Chem., (2013) 56:20:8019',\n",
" u'J. Med. Chem., (2014) 57:4:1437']"
]
}
],
"prompt_number": 70
},
{
"cell_type": "code",
"collapsed": false,
"input": [],
"language": "python",
"metadata": {},
"outputs": []
}
],
"metadata": {}
}
]
}
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