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SMILES: Clc1ccccc1C(N1CCN(CC1)C(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1

InChI Key: InChIKey=JWHAZXDKSGAIEK-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50481475   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Voltage-dependent L-type calcium channel subunit beta-1


(Homo sapiens)		BDBM50481475
PNG
(CHEMBL598592)
Show SMILES Clc1ccccc1C(N1CCN(CC1)C(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C32H31ClN2O/c33-30-19-11-10-18-28(30)32(27-16-8-3-9-17-27)35-22-20-34(21-23-35)31(36)24-29(25-12-4-1-5-13-25)26-14-6-2-7-15-26/h1-19,29,32H,20-24H2
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



Neuromed Pharmaceuticals Ltd

Curated by ChEMBL


Assay Description
Inhibition of N type calcium channel alpha-1b/alpha-2-delta-1/beta-1b expressed in HEK293 cells at holding potential of -100 mV by whole-cell patch c...

Bioorg Med Chem Lett 20: 1378-83 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.008
BindingDB Entry DOI: 10.7270/Q2DJ5JDR
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C/L-type calcium channel subunit beta-1/calcium channel subunit alpha-2/delta-1


(Homo sapiens (Human))		BDBM50481475
PNG
(CHEMBL598592)
Show SMILES Clc1ccccc1C(N1CCN(CC1)C(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C32H31ClN2O/c33-30-19-11-10-18-28(30)32(27-16-8-3-9-17-27)35-22-20-34(21-23-35)31(36)24-29(25-12-4-1-5-13-25)26-14-6-2-7-15-26/h1-19,29,32H,20-24H2
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
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AffyNet 
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.06E+5n/an/an/an/an/an/a



Neuromed Pharmaceuticals Ltd

Curated by ChEMBL


Assay Description
Inhibition of L type calcium channel alpha-1c/alpha-2-delta-1/beta-1b expressed in HEK293 cells in presence of -100 mV holding potential by whole-cel...

Bioorg Med Chem Lett 20: 1378-83 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.008
BindingDB Entry DOI: 10.7270/Q2DJ5JDR
More data for this
Ligand-Target Pair