BDBM50422200 CHEMBL278804

SMILES: COc1ccc(cc1)[C@@H]1Sc2ccc(Cl)cc2-n2c(CN(C)C)ccc2[C@@H]1OC(C)=O

InChI Key: InChIKey=VEDSMTGXXDIVMG-ZEQRLZLVSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50422200   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Cav1.3/Cav beta3/Cav alpha2delta complex (Rattus norvegicus)	BDBM50422200 (CHEMBL278804) Show SMILES COc1ccc(cc1)[C@@H]1Sc2ccc(Cl)cc2-n2c(CN(C)C)ccc2[C@@H]1OC(C)=O Show InChI InChI=1S/C24H25ClN2O3S/c1-15(28)30-23-20-11-8-18(14-26(2)3)27(20)21-13-17(25)7-12-22(21)31-24(23)16-5-9-19(29-4)10-6-16/h5-13,23-24H,14H2,1-4H3/t23-,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of [3H]nitrendipine binding to L-type [Ca2+] channel in rat cortex homogenate, activity expressed as pIC50				J Med Chem 40: 125-31 (1997) Article DOI: 10.1021/jm9605647 BindingDB Entry DOI: 10.7270/Q2JQ128M
					More data for this Ligand-Target Pair