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BDBM50302360 (+/-)-2-hydroxy-N-(1-(4'-(4-propoxyphenoxy)biphenyl-4-yl)ethyl)propanamide::CHEMBL566861

SMILES: CCCOc1ccc(Oc2ccc(cc2)-c2ccc(cc2)C(C)NC(=O)C(C)O)cc1

InChI Key: InChIKey=LONHCXUKBQXAMV-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50302360   
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))
BDBM50302360
PNG
((+/-)-2-hydroxy-N-(1-(4'-(4-propoxyphenoxy)bipheny...)
Show SMILES CCCOc1ccc(Oc2ccc(cc2)-c2ccc(cc2)C(C)NC(=O)C(C)O)cc1
Show InChI InChI=1S/C26H29NO4/c1-4-17-30-23-13-15-25(16-14-23)31-24-11-9-22(10-12-24)21-7-5-20(6-8-21)18(2)27-26(29)19(3)28/h5-16,18-19,28H,4,17H2,1-3H3,(H,27,29)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.84E+3n/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))
BDBM50302360
PNG
((+/-)-2-hydroxy-N-(1-(4'-(4-propoxyphenoxy)bipheny...)
Show SMILES CCCOc1ccc(Oc2ccc(cc2)-c2ccc(cc2)C(C)NC(=O)C(C)O)cc1
Show InChI InChI=1S/C26H29NO4/c1-4-17-30-23-13-15-25(16-14-23)31-24-11-9-22(10-12-24)21-7-5-20(6-8-21)18(2)27-26(29)19(3)28/h5-16,18-19,28H,4,17H2,1-3H3,(H,27,29)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.06E+3n/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