BDBM50422196 CHEMBL25512

SMILES: COc1ccc(cc1)[C@@H]1Sc2ccccc2N2[C@H]1CCC2=O

InChI Key: InChIKey=YVAWKMIGJCZPDD-YJBOKZPZSA-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 = 50422196   

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)	BDBM50422196 (CHEMBL25512) Show SMILES COc1ccc(cc1)[C@@H]1Sc2ccccc2N2[C@H]1CCC2=O Show InChI InChI=1S/C18H17NO2S/c1-21-13-8-6-12(7-9-13)18-15-10-11-17(20)19(15)14-4-2-3-5-16(14)22-18/h2-9,15,18H,10-11H2,1H3/t15-,18-/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	4.40	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