BDBM138735 US8877741, 2.61

SMILES: C[C@H](NC(=O)c1cc(C)on1)c1ccc(OC2CCN(C2)c2cccc(n2)C(F)(F)F)cc1

InChI Key: InChIKey=GJWMIDMBRGQLEH-BUSXIPJBSA-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 = 138735   

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))	BDBM138735 (US8877741, 2.61) Show SMILES C[C@H](NC(=O)c1cc(C)on1)c1ccc(OC2CCN(C2)c2cccc(n2)C(F)(F)F)cc1 |r| Show InChI InChI=1S/C23H23F3N4O3/c1-14-12-19(29-33-14)22(31)27-15(2)16-6-8-17(9-7-16)32-18-10-11-30(13-18)21-5-3-4-20(28-21)23(24,25)26/h3-9,12,15,18H,10-11,13H2,1-2H3,(H,27,31)/t15-,18?/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	35	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
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