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SMILES: COc1ccc(cc1Cl)C1C(C=NC=C1C(=O)OC\C=C\c1ccccc1)C(O)=O

InChI Key: InChIKey=VOCNYHMOYGBBEA-VMPITWQZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50383771   
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 N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))		BDBM50383771
PNG
(CHEMBL2030602)
Show SMILES COc1ccc(cc1Cl)C1C(C=NC=C1C(=O)OC\C=C\c1ccccc1)C(O)=O |c:12,14|
Show InChI InChI=1S/C23H20ClNO5/c1-29-20-10-9-16(12-19(20)24)21-17(22(26)27)13-25-14-18(21)23(28)30-11-5-8-15-6-3-2-4-7-15/h2-10,12-14,17,21H,11H2,1H3,(H,26,27)/b8-5+
PDB

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



Ajinomoto Pharmaceuticals Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of N-type voltage-dependent calcium channel CaV2.2 in human IMR32 cells assessed as inhibition of KCl-induced increase in intracellular ca...

Bioorg Med Chem Lett 22: 3639-42 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.051
BindingDB Entry DOI: 10.7270/Q2QV3NJX
More data for this
Ligand-Target Pair