BDBM50537185 CHEMBL4483435

SMILES: COc1cc(c(OC)nc1OC)C(O)(CCN(C)C)C(c1ccnc(OC)c1OC)c1cc2cc(Br)ccc2nc1OC

InChI Key: InChIKey=ZCRAGXDCNCYQPH-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50537185   

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
1,3-beta-glucan synthase component GLS2 (Saccharomyces cerevisiae)	BDBM50537185 (CHEMBL4483435) Show SMILES COc1cc(c(OC)nc1OC)C(O)(CCN(C)C)C(c1ccnc(OC)c1OC)c1cc2cc(Br)ccc2nc1OC Show InChI InChI=1S/C31H37BrN4O7/c1-36(2)14-12-31(37,22-17-24(38-3)29(42-7)35-28(22)41-6)25(20-11-13-33-30(43-8)26(20)39-4)21-16-18-15-19(32)9-10-23(18)34-27(21)40-5/h9-11,13,15-17,25,37H,12,14H2,1-8H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Inhibition of human ERG by manual patch clamp electrophysiology assay				Bioorg Med Chem 27: 1283-1291 (2019) Article DOI: 10.1016/j.bmc.2019.02.025
					More data for this Ligand-Target Pair