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BDBM50302363 CHEMBL585670::N-(1-(4'-(4-propoxyphenoxy)biphenyl-4-yl)ethyl)pentanamide

SMILES: CCCCC(=O)NC(C)c1ccc(cc1)-c1ccc(Oc2ccc(OCCC)cc2)cc1

InChI Key: InChIKey=OLXZHWDLQVSTGZ-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50302363   
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))
BDBM50302363
PNG
(CHEMBL585670 | N-(1-(4'-(4-propoxyphenoxy)biphenyl...)
Show SMILES CCCCC(=O)NC(C)c1ccc(cc1)-c1ccc(Oc2ccc(OCCC)cc2)cc1
Show InChI InChI=1S/C28H33NO3/c1-4-6-7-28(30)29-21(3)22-8-10-23(11-9-22)24-12-14-26(15-13-24)32-27-18-16-25(17-19-27)31-20-5-2/h8-19,21H,4-7,20H2,1-3H3,(H,29,30)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ACC 2 expressed in baculovirus expression system by FAS-coupled assay


Bioorg Med Chem Lett 19: 5872-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.077
BindingDB Entry DOI: 10.7270/Q24J0F6F
More data for this
Ligand-Target Pair
Acetyl-CoA carboxylase 1 (ACC1)


(Homo sapiens (Human))
BDBM50302363
PNG
(CHEMBL585670 | N-(1-(4'-(4-propoxyphenoxy)biphenyl...)
Show SMILES CCCCC(=O)NC(C)c1ccc(cc1)-c1ccc(Oc2ccc(OCCC)cc2)cc1
Show InChI InChI=1S/C28H33NO3/c1-4-6-7-28(30)29-21(3)22-8-10-23(11-9-22)24-12-14-26(15-13-24)32-27-18-16-25(17-19-27)31-20-5-2/h8-19,21H,4-7,20H2,1-3H3,(H,29,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ACC 1 expressed in baculovirus expression system by FAS-coupled assay


Bioorg Med Chem Lett 19: 5872-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.077
BindingDB Entry DOI: 10.7270/Q24J0F6F
More data for this
Ligand-Target Pair