Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ATP-dependent translocase ABCB1' and Ligand = 'BDBM50423808'   

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-dependent translocase ABCB1 (Homo sapiens (Human))	BDBM50423808 (CHEMBL1822227) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6](-[#6])=[#6]-c1c(-[#8])cc(-[#8])c2c1oc(cc2=O)-c1ccccc1 |w:8.8| Show InChI InChI=1S/C24H24O4/c1-15(2)8-7-9-16(3)12-18-19(25)13-20(26)23-21(27)14-22(28-24(18)23)17-10-5-4-6-11-17/h4-6,8,10-14,25-26H,7,9H2,1-3H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a
Chosun University Curated by ChEMBL					Assay Description Binding affinity to ABCB1 nucleotide binding domain 2				Eur J Med Chem 46: 4078-88 (2011) Article DOI: 10.1016/j.ejmech.2011.06.008 BindingDB Entry DOI: 10.7270/Q2FJ2J3W
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