BDBM50242996 CHEMBL4062876

SMILES: Brc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1

InChI Key: InChIKey=DKZOWIRJGPDRCA-UHFFFAOYSA-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 = 50242996   

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
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50242996 (CHEMBL4062876) Show SMILES Brc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:10| Show InChI InChI=1S/C19H14BrNOS/c20-14-9-7-13(8-10-14)19-12-16(17-5-3-11-22-17)21-15-4-1-2-6-18(15)23-19/h1-11,19H,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair