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BDBM131354 US8835472, 9.21

SMILES: CC(Cc1ccc(cc1)C#Cc1ccc(OCCC2CC2)cc1)NC(C)=O

InChI Key: InChIKey=AXUWCRKFFXZXPO-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 131354   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Acetyl-CoA carboxylase 2 (ACC2)


(Homo sapiens (Human))
BDBM131354
PNG
(US8835472, 9.21)
Show SMILES CC(Cc1ccc(cc1)C#Cc1ccc(OCCC2CC2)cc1)NC(C)=O
Show InChI InChI=1/C24H27NO2/c1-18(25-19(2)26)17-23-9-7-20(8-10-23)3-4-21-11-13-24(14-12-21)27-16-15-22-5-6-22/h7-14,18,22H,5-6,15-17H2,1-2H3,(H,25,26)
PDB
MMDB

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PC sid
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Similars

US Patent
n/an/a 60n/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 US8835472 (2014)


BindingDB Entry DOI: 10.7270/Q25T3J6W
More data for this
Ligand-Target Pair