BDBM138649 US8877741, 1.127

SMILES: COc1c(OCC2CC2)nccc1N1CC[C@H](C1)Oc1ccc(cc1)[C@H](C)NC(C)=O

InChI Key: InChIKey=KNBWNJIHRTVFDK-HRAATJIYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 138649   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acetyl-CoA carboxylase 2 (ACC2) (Homo sapiens (Human))	BDBM138649 (US8877741, 1.127) Show SMILES COc1c(OCC2CC2)nccc1N1CC[C@H](C1)Oc1ccc(cc1)[C@H](C)NC(C)=O |r| Show InChI InChI=1S/C24H31N3O4/c1-16(26-17(2)28)19-6-8-20(9-7-19)31-21-11-13-27(14-21)22-10-12-25-24(23(22)29-3)30-15-18-4-5-18/h6-10,12,16,18,21H,4-5,11,13-15H2,1-3H3,(H,26,28)/t16-,21+/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	31	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