Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ATP-binding cassette sub-family G member 2' and Ligand = 'BDBM50202240'   

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
ATP-binding cassette sub-family G member 2 (Homo sapiens (Human))	BDBM50202240 (CHEMBL3947261) Show SMILES COc1ccc2[nH]cc(CCNC(=O)C(CC(C)C)NC(=O)c3cc(=O)c4c(OCc5ccc(Br)cc5)cccc4o3)c2c1 Show InChI InChI=1S/C34H34BrN3O6/c1-20(2)15-27(33(40)36-14-13-22-18-37-26-12-11-24(42-3)16-25(22)26)38-34(41)31-17-28(39)32-29(5-4-6-30(32)44-31)43-19-21-7-9-23(35)10-8-21/h4-12,16-18,20,27,37H,13-15,19H2,1-3H3,(H,36,40)(H,38,41)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	910	n/a	n/a	n/a	n/a
Universit£ Lyon 1 Curated by ChEMBL					Assay Description Inhibition of ABCG2 (unknown origin) expressed in HEK293 cells assessed as reduction in mitoxantrone efflux after 30 mins by flow cytometric analysis				Eur J Med Chem 122: 291-301 (2016) Article DOI: 10.1016/j.ejmech.2016.05.053 BindingDB Entry DOI: 10.7270/Q28K7C22
					More data for this Ligand-Target Pair