BDBM131575 US8835472, 13.79

SMILES: CC(Cc1ccc(cc1)C#Cc1cnc(NCc2ccc(C)cc2)nc1)NC(C)=O

InChI Key: InChIKey=DUSHLGFKEITIJD-UHFFFAOYSA-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 = 131575   

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))	BDBM131575 (US8835472, 13.79) Show SMILES CC(Cc1ccc(cc1)C#Cc1cnc(NCc2ccc(C)cc2)nc1)NC(C)=O Show InChI InChI=1S/C25H26N4O/c1-18-4-6-23(7-5-18)15-26-25-27-16-24(17-28-25)13-10-21-8-11-22(12-9-21)14-19(2)29-20(3)30/h4-9,11-12,16-17,19H,14-15H2,1-3H3,(H,29,30)(H,26,27,28)	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	110	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 US8835472 (2014) BindingDB Entry DOI: 10.7270/Q25T3J6W
					More data for this Ligand-Target Pair