BDBM50482263 CHEMBL1170718

SMILES: CC(=O)N1CCC(CC1)C(=O)N1CCC(CC1)N1CCN(CC1)C(=O)c1cc(nc(c1)-c1ccc2[nH]ncc2c1)-c1ccccc1

InChI Key: InChIKey=PBKLUNRFLIHUNF-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 = 50482263   

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 (Homo sapiens (Human))	BDBM50482263 (CHEMBL1170718) Show SMILES CC(=O)N1CCC(CC1)C(=O)N1CCC(CC1)N1CCN(CC1)C(=O)c1cc(nc(c1)-c1ccc2[nH]ncc2c1)-c1ccccc1 Show InChI InChI=1S/C36H41N7O3/c1-25(44)40-13-9-27(10-14-40)35(45)42-15-11-31(12-16-42)41-17-19-43(20-18-41)36(46)29-22-33(26-5-3-2-4-6-26)38-34(23-29)28-7-8-32-30(21-28)24-37-39-32/h2-8,21-24,27,31H,9-20H2,1H3,(H,37,39)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human ACC1/2-mediated malonyl-CoA synthesis				Bioorg Med Chem Lett 20: 3965-8 (2010) Article DOI: 10.1016/j.bmcl.2010.04.134 BindingDB Entry DOI: 10.7270/Q2F76GC2
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