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BDBM23074 3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]propan-1-one::alpha-ketooxazole, 11f

SMILES: O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1

InChI Key: InChIKey=NPLDDPZWNXUZQF-UHFFFAOYSA-N

Data: 3 KI  5 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 7 hits for monomerid = 23074   
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
Fatty Acid Amide Hydrolase


(Homo sapiens (Human))
BDBM23074
PNG
(3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol...)
Show SMILES O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1
Show InChI InChI=1S/C23H18N2O3/c26-21(23-25-16-22(28-23)20-8-4-5-15-24-20)14-11-17-9-12-19(13-10-17)27-18-6-2-1-3-7-18/h1-10,12-13,15-16H,11,14H2
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MMDB

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3.40 -11.5 2n/an/an/an/an/a25



The Scripps Research Institute



Assay Description
The inhibition assays were performed by incubating enzyme, 14C-labeled oleamide in reaction buffer at room temperature in the presence of three diffe...


J Med Chem 50: 3359-68 (2007)


Article DOI: 10.1021/jm061414r
BindingDB Entry DOI: 10.7270/Q2DR2SSH
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM23074
PNG
(3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol...)
Show SMILES O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1
Show InChI InChI=1S/C23H18N2O3/c26-21(23-25-16-22(28-23)20-8-4-5-15-24-20)14-11-17-9-12-19(13-10-17)27-18-6-2-1-3-7-18/h1-10,12-13,15-16H,11,14H2
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3.40n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant FAAH expressed in Escherichia coli


J Med Chem 51: 937-47 (2008)


Article DOI: 10.1021/jm701210y
BindingDB Entry DOI: 10.7270/Q2QV3NCP
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM23074
PNG
(3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol...)
Show SMILES O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1
Show InChI InChI=1S/C23H18N2O3/c26-21(23-25-16-22(28-23)20-8-4-5-15-24-20)14-11-17-9-12-19(13-10-17)27-18-6-2-1-3-7-18/h1-10,12-13,15-16H,11,14H2
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PubMed
3.40n/an/an/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant FAAH expressed in Escherichia coli


J Med Chem 51: 937-47 (2008)


Article DOI: 10.1021/jm701210y
BindingDB Entry DOI: 10.7270/Q2QV3NCP
More data for this
Ligand-Target Pair
Acyl-CoA: cholesterol acyltransferase (ACAT)


(Homo sapiens (Human))
BDBM23074
PNG
(3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol...)
Show SMILES O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1
Show InChI InChI=1S/C23H18N2O3/c26-21(23-25-16-22(28-23)20-8-4-5-15-24-20)14-11-17-9-12-19(13-10-17)27-18-6-2-1-3-7-18/h1-10,12-13,15-16H,11,14H2
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n/an/a 200n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGH


J Med Chem 51: 937-47 (2008)


Article DOI: 10.1021/jm701210y
BindingDB Entry DOI: 10.7270/Q2QV3NCP
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM23074
PNG
(3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol...)
Show SMILES O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1
Show InChI InChI=1S/C23H18N2O3/c26-21(23-25-16-22(28-23)20-8-4-5-15-24-20)14-11-17-9-12-19(13-10-17)27-18-6-2-1-3-7-18/h1-10,12-13,15-16H,11,14H2
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UniChem

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Article
PubMed
n/an/a 2n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat recombinant FAAH expressed in Escherichia coli


J Med Chem 51: 937-47 (2008)


Article DOI: 10.1021/jm701210y
BindingDB Entry DOI: 10.7270/Q2QV3NCP
More data for this
Ligand-Target Pair
Neutral cholesterol ester hydrolase 1


(Homo sapiens (Human))
BDBM23074
PNG
(3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol...)
Show SMILES O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1
Show InChI InChI=1S/C23H18N2O3/c26-21(23-25-16-22(28-23)20-8-4-5-15-24-20)14-11-17-9-12-19(13-10-17)27-18-6-2-1-3-7-18/h1-10,12-13,15-16H,11,14H2
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PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of KIAA1363


J Med Chem 51: 937-47 (2008)


Article DOI: 10.1021/jm701210y
BindingDB Entry DOI: 10.7270/Q2QV3NCP
More data for this
Ligand-Target Pair
Triacylglycerol Hydrolase


(Homo sapiens (Human))
BDBM23074
PNG
(3-(4-phenoxyphenyl)-1-[5-(pyridin-2-yl)-1,3-oxazol...)
Show SMILES O=C(CCc1ccc(Oc2ccccc2)cc1)c1ncc(o1)-c1ccccn1
Show InChI InChI=1S/C23H18N2O3/c26-21(23-25-16-22(28-23)20-8-4-5-15-24-20)14-11-17-9-12-19(13-10-17)27-18-6-2-1-3-7-18/h1-10,12-13,15-16H,11,14H2
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 200n/an/an/an/an/a25



The Scripps Research Institute



Assay Description
Inhibition of TGH activity was assayed using COS-7 expressed TGH and the chromogenic substrate. IC50 values were determined from the inhibition obser...


J Med Chem 50: 3359-68 (2007)


Article DOI: 10.1021/jm061414r
BindingDB Entry DOI: 10.7270/Q2DR2SSH
More data for this
Ligand-Target Pair