BDBM131523 US8835472, 13.27

SMILES: CC(Cc1ccc(cc1)C#Cc1cnc(NC2CCC2)nc1)NC(=O)N(C)C

InChI Key: InChIKey=MNVUJUNWOIUSIM-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 = 131523   

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))	BDBM131523 (US8835472, 13.27) Show SMILES CC(Cc1ccc(cc1)C#Cc1cnc(NC2CCC2)nc1)NC(=O)N(C)C Show InChI InChI=1S/C22H27N5O/c1-16(25-22(28)27(2)3)13-18-10-7-17(8-11-18)9-12-19-14-23-21(24-15-19)26-20-5-4-6-20/h7-8,10-11,14-16,20H,4-6,13H2,1-3H3,(H,25,28)(H,23,24,26)	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	120	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