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BDBM212616 US9278954, 1.7

SMILES: CC(C(=O)NC1CC1)c1ccc(O[C@@H]2CCN(C2)c2nc(ncc2F)N(C)C)cc1

InChI Key: InChIKey=BJAILXITAMPWQJ-XPKAQORNSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 212616   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM212616
PNG
(US9278954, 1.7)
Show SMILES CC(C(=O)NC1CC1)c1ccc(O[C@@H]2CCN(C2)c2nc(ncc2F)N(C)C)cc1
Show InChI InChI=1S/C22H28FN5O2/c1-14(21(29)25-16-6-7-16)15-4-8-17(9-5-15)30-18-10-11-28(13-18)20-19(23)12-24-22(26-20)27(2)3/h4-5,8-9,12,14,16,18H,6-7,10-11,13H2,1-3H3,(H,25,29)/t14?,18-/m1/s1
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 170n/an/an/an/a7.5n/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 US9278954 (2016)


BindingDB Entry DOI: 10.7270/Q2RB73FM
More data for this
Ligand-Target Pair