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PubMed code 2435903

Compile data set for download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Voltage-dependent L-type calcium channel subunit alpha-1C


(Homo sapiens (Human))		BDBM50016388
PNG
(5-(2-Dimethylamino-ethyl)-4-methyl-2-(3-nitro-phen...)
Show SMILES COC(=O)C1=C(C)N(CCN(C)C)c2ccccc2SC1c1cccc(c1)[N+]([O-])=O |c:4|
Show InChI InChI=1S/C22H25N3O4S/c1-15-20(22(26)29-4)21(16-8-7-9-17(14-16)25(27)28)30-19-11-6-5-10-18(19)24(15)13-12-23(2)3/h5-11,14,21H,12-13H2,1-4H3
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 505n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-diltiazem binding to calcium channels of guinea pig myocardium

J Med Chem 30: 635-40 (1987)


BindingDB Entry DOI: 10.7270/Q25B01G9
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(Oryctolagus cuniculus)		BDBM50016385
PNG
(4-Methyl-2-(3-nitro-phenyl)-2,5-dihydro-benzo[b][1...)
Show SMILES COC(=[OH+])C1=C(C)[N-]c2ccccc2SC1c1cccc(c1)[N+]([O-])=O |c:4|
Show InChI InChI=1S/C18H16N2O4S/c1-11-16(18(21)24-2)17(12-6-5-7-13(10-12)20(22)23)25-15-9-4-3-8-14(15)19-11/h3-10,17H,1-2H3,(H,19,21)
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n/an/a 140n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Reduction in amplitude of calcium-dependent slow-response action potential by blocking voltage sensitive calcium channel

J Med Chem 30: 635-40 (1987)


BindingDB Entry DOI: 10.7270/Q25B01G9
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(Homo sapiens (Human))		BDBM50016385
PNG
(4-Methyl-2-(3-nitro-phenyl)-2,5-dihydro-benzo[b][1...)
Show SMILES COC(=[OH+])C1=C(C)[N-]c2ccccc2SC1c1cccc(c1)[N+]([O-])=O |c:4|
Show InChI InChI=1S/C18H16N2O4S/c1-11-16(18(21)24-2)17(12-6-5-7-13(10-12)20(22)23)25-15-9-4-3-8-14(15)19-11/h3-10,17H,1-2H3,(H,19,21)
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n/an/an/a 360n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-nitrendipine binding to calcium channels of guinea pig myocardium

J Med Chem 30: 635-40 (1987)


BindingDB Entry DOI: 10.7270/Q25B01G9
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(Homo sapiens (Human))		BDBM50016388
PNG
(5-(2-Dimethylamino-ethyl)-4-methyl-2-(3-nitro-phen...)
Show SMILES COC(=O)C1=C(C)N(CCN(C)C)c2ccccc2SC1c1cccc(c1)[N+]([O-])=O |c:4|
Show InChI InChI=1S/C22H25N3O4S/c1-15-20(22(26)29-4)21(16-8-7-9-17(14-16)25(27)28)30-19-11-6-5-10-18(19)24(15)13-12-23(2)3/h5-11,14,21H,12-13H2,1-4H3
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

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PubMed
n/an/an/a 488n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [3H]-nitrendipine binding to calcium channels of guinea pig myocardium

J Med Chem 30: 635-40 (1987)


BindingDB Entry DOI: 10.7270/Q25B01G9
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%