Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fatty acid-binding protein, adipocyte' and Ligand = 'BDBM234684'   

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
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM234684 (US9353102, 6.1) Show SMILES OC(=O)C1=C(CCC1)C(=O)Nc1sccc1-c1nc(no1)C1CC1 |t:3| Show InChI InChI=1S/C16H15N3O4S/c20-13(9-2-1-3-10(9)16(21)22)18-15-11(6-7-24-15)14-17-12(19-23-14)8-4-5-8/h6-8H,1-5H2,(H,18,20)(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	7.5	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Stock DMSO solutions (1.8 mM) of compounds were serially diluted 3-fold for ten concentrations with 100% DMSO (50 μM to 0.003 μM final comp...				US Patent US9353102 (2016) BindingDB Entry DOI: 10.7270/Q23F4NH4
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