Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetyl-CoA carboxylase 2' and Ligand = 'BDBM369663'   

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
Acetyl-CoA carboxylase 2 (Homo sapiens (Human))	BDBM369663 (US10233156, Example I-202) Show SMILES C[C@@H](CO[C@H]1CC[C@@H](CC1)Oc1nc2ccc(OC3(C)CC3)cc2n1C)NC(C)=O |r,wU:7.10,1.0,wD:4.3,(6.94,-2.54,;6.94,-1,;5.61,-.23,;4.27,-1,;2.94,-.23,;2.94,1.31,;1.61,2.08,;.27,1.31,;.27,-.23,;1.61,-1,;-1.06,2.08,;-2.4,1.31,;-2.56,-.23,;-4.06,-.55,;-4.83,-1.88,;-6.37,-1.88,;-7.14,-.55,;-8.68,-.55,;-9.45,-1.88,;-10.94,-1.48,;-10.79,-2.65,;-9.45,-3.42,;-6.37,.79,;-4.83,.79,;-3.8,1.93,;-4.2,3.42,;8.27,-.23,;9.61,-1,;10.94,-.23,;9.61,-2.54,)| Show InChI InChI=1S/C23H33N3O4/c1-15(24-16(2)27)14-28-17-5-7-18(8-6-17)29-22-25-20-10-9-19(13-21(20)26(22)4)30-23(3)11-12-23/h9-10,13,15,17-18H,5-8,11-12,14H2,1-4H3,(H,24,27)/t15-,17-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories					Assay Description Recombinant human ACC1 and recombinant human ACC2, which were prepared by the method mentioned above, were preincubated with assay buffer solution (5...				J Med Chem 50: 641-62 (2007) BindingDB Entry DOI: 10.7270/Q2C53P4Z
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