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SMILES: COC(OC)C1=C(C(C(C=N1)C(O)=O)c1ccc(OC)c(Cl)c1)C(=O)OC\C=C\c1ccccc1

InChI Key: InChIKey=FIKMDSGXQRZVPM-JXMROGBWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50383777   
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))		BDBM50383777
PNG
(CHEMBL2030595)
Show SMILES COC(OC)C1=C(C(C(C=N1)C(O)=O)c1ccc(OC)c(Cl)c1)C(=O)OC\C=C\c1ccccc1 |c:9,t:5|
Show InChI InChI=1S/C26H26ClNO7/c1-32-20-12-11-17(14-19(20)27)21-18(24(29)30)15-28-23(26(33-2)34-3)22(21)25(31)35-13-7-10-16-8-5-4-6-9-16/h4-12,14-15,18,21,26H,13H2,1-3H3,(H,29,30)/b10-7+
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Similars
Article
PubMed
n/an/a 1.50E+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