Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Acetyl-CoA carboxylase 2' and Ligand = 'BDBM138537'   

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))	BDBM138537 (US8877741, 1.15 | US8877741, 1.35) Show SMILES C[C@H](NC(C)=O)c1ccc(OC2CCN(C2)c2ccnc(OCC3CC3)c2)cc1 |r| Show InChI InChI=1S/C23H29N3O3/c1-16(25-17(2)27)19-5-7-21(8-6-19)29-22-10-12-26(14-22)20-9-11-24-23(13-20)28-15-18-3-4-18/h5-9,11,13,16,18,22H,3-4,10,12,14-15H2,1-2H3,(H,25,27)/t16-,22?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	60	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...				US Patent US8877741 (2014) BindingDB Entry DOI: 10.7270/Q2R78CXJ
					More data for this Ligand-Target Pair
Acetyl-CoA carboxylase 2 (Homo sapiens (Human))	BDBM138537 (US8877741, 1.15 | US8877741, 1.35) Show SMILES C[C@H](NC(C)=O)c1ccc(OC2CCN(C2)c2ccnc(OCC3CC3)c2)cc1 |r| Show InChI InChI=1S/C23H29N3O3/c1-16(25-17(2)27)19-5-7-21(8-6-19)29-22-10-12-26(14-22)20-9-11-24-23(13-20)28-15-18-3-4-18/h5-9,11,13,16,18,22H,3-4,10,12,14-15H2,1-2H3,(H,25,27)/t16-,22?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	414	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...				US Patent US8877741 (2014) BindingDB Entry DOI: 10.7270/Q2R78CXJ
					More data for this Ligand-Target Pair