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SMILES: COC(OC)C1=C(C(C(C=N1)C(O)=O)c1cc(Cl)c(OC)c(Cl)c1)C(=O)OC\C=C\c1ccccc1

InChI Key: InChIKey=PPMUFDFOWYPDMU-JXMROGBWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50383778   
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))		BDBM50383778
PNG
(CHEMBL2030596)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1cc(Cl)c(OC)c(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C26H25Cl2NO7/c1-33-23-18(27)12-16(13-19(23)28)20-17(24(30)31)14-29-22(26(34-2)35-3)21(20)25(32)36-11-7-10-15-8-5-4-6-9-15/h4-10,12-14,17,20,26H,11H2,1-3H3,(H,30,31)/b10-7+
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PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.20E+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