Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Voltage-dependent L-type calcium channel subunit alpha-1D' and Ligand = 'BDBM50317815'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Voltage-dependent L-type calcium channel subunit alpha-1D (Rattus norvegicus)	BDBM50317815 (3-benzyl 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1...) Show SMILES COC(=O)C1C(C(C(=O)OCc2ccccc2)=C(C)N=C1C)c1cccc(c1)[N+]([O-])=O |c:20,t:17| Show InChI InChI=1S/C23H22N2O6/c1-14-19(22(26)30-3)21(17-10-7-11-18(12-17)25(28)29)20(15(2)24-14)23(27)31-13-16-8-5-4-6-9-16/h4-12,19,21H,13H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Antagonist activity at rat Cav1.3 expressed in HEK293 cells assessed as inhibition of voltage pulse-induced calcium current by FLIPR calcium 4 assay				Bioorg Med Chem 18: 3147-58 (2010) Article DOI: 10.1016/j.bmc.2010.03.038 BindingDB Entry DOI: 10.7270/Q2F47P90
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