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Compile Data Set for Download or QSAR

Found 16 hits Enz. Inhib. hit(s) with all data for entry = 50020915   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218953
PNG
(3-(benzo[d]oxazole-2-carbonyl)phenyl cyclopentylca...)
Show SMILES O=C(NC1CCCC1)Oc1cccc(c1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C20H18N2O4/c23-18(19-22-16-10-3-4-11-17(16)26-19)13-6-5-9-15(12-13)25-20(24)21-14-7-1-2-8-14/h3-6,9-12,14H,1-2,7-8H2,(H,21,24)
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n/an/a 28n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218944
PNG
(3-(benzo[d]oxazole-2-carbonyl)phenyl m-methylbenzy...)
Show SMILES Cc1cccc(CNC(=O)Oc2cccc(c2)C(=O)c2nc3ccccc3o2)c1
Show InChI InChI=1S/C23H18N2O4/c1-15-6-4-7-16(12-15)14-24-23(27)28-18-9-5-8-17(13-18)21(26)22-25-19-10-2-3-11-20(19)29-22/h2-13H,14H2,1H3,(H,24,27)
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n/an/a 32n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218941
PNG
(3-(benzo[d]thiazole-2-carbonyl)phenyl 3-methylbenz...)
Show SMILES Cc1cccc(CNC(=O)Oc2cccc(c2)C(=O)c2nc3ccccc3s2)c1
Show InChI InChI=1S/C23H18N2O3S/c1-15-6-4-7-16(12-15)14-24-23(27)28-18-9-5-8-17(13-18)21(26)22-25-19-10-2-3-11-20(19)29-22/h2-13H,14H2,1H3,(H,24,27)
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n/an/a 38n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218952
PNG
(3-(benzo[d]thiazole-2-carbonyl)phenyl cyclopentylc...)
Show SMILES O=C(NC1CCCC1)Oc1cccc(c1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C20H18N2O3S/c23-18(19-22-16-10-3-4-11-17(16)26-19)13-6-5-9-15(12-13)25-20(24)21-14-7-1-2-8-14/h3-6,9-12,14H,1-2,7-8H2,(H,21,24)
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n/an/a 47n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218950
PNG
(3-(benzo[d]oxazole-2-carbonyl)phenyl cyclohexylcar...)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(c1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C21H20N2O4/c24-19(20-23-17-11-4-5-12-18(17)27-20)14-7-6-10-16(13-14)26-21(25)22-15-8-2-1-3-9-15/h4-7,10-13,15H,1-3,8-9H2,(H,22,25)
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n/an/a 47n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218943
PNG
(3-(benzo[d]oxazole-2-carbonyl)phenyl butylcarbamat...)
Show SMILES CCCCNC(=O)Oc1cccc(c1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C19H18N2O4/c1-2-3-11-20-19(23)24-14-8-6-7-13(12-14)17(22)18-21-15-9-4-5-10-16(15)25-18/h4-10,12H,2-3,11H2,1H3,(H,20,23)
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n/an/a 54n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218951
PNG
(3-(benzo[d]thiazole-2-carbonyl)phenyl cyclohexylca...)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(c1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C21H20N2O3S/c24-19(20-23-17-11-4-5-12-18(17)27-20)14-7-6-10-16(13-14)26-21(25)22-15-8-2-1-3-9-15/h4-7,10-13,15H,1-3,8-9H2,(H,22,25)
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n/an/a 56n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218956
PNG
(3-(benzo[d]thiazole-2-carbonyl)phenyl butylcarbama...)
Show SMILES CCCCNC(=O)Oc1cccc(c1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C19H18N2O3S/c1-2-3-11-20-19(23)24-14-8-6-7-13(12-14)17(22)18-21-15-9-4-5-10-16(15)25-18/h4-10,12H,2-3,11H2,1H3,(H,20,23)
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n/an/a 103n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218945
PNG
(3-(benzo[d]oxazole-2-carbonyl)phenyl propylcarbama...)
Show SMILES CCCNC(=O)Oc1cccc(c1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C18H16N2O4/c1-2-10-19-18(22)23-13-7-5-6-12(11-13)16(21)17-20-14-8-3-4-9-15(14)24-17/h3-9,11H,2,10H2,1H3,(H,19,22)
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n/an/a 109n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218955
PNG
(3-(benzo[d]thiazole-2-carbonyl)phenyl benzylcarbam...)
Show SMILES O=C(NCc1ccccc1)Oc1cccc(c1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C22H16N2O3S/c25-20(21-24-18-11-4-5-12-19(18)28-21)16-9-6-10-17(13-16)27-22(26)23-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,23,26)
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n/an/a 121n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218942
PNG
(4-(benzo[d]oxazole-2-carbonyl)phenyl 2-methylbenzy...)
Show SMILES Cc1ccccc1CNC(=O)Oc1ccc(cc1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C23H18N2O4/c1-15-6-2-3-7-17(15)14-24-23(27)28-18-12-10-16(11-13-18)21(26)22-25-19-8-4-5-9-20(19)29-22/h2-13H,14H2,1H3,(H,24,27)
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n/an/a 137n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218954
PNG
(3-(benzo[d]thiazole-2-carbonyl)phenyl propylcarbam...)
Show SMILES CCCNC(=O)Oc1cccc(c1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C18H16N2O3S/c1-2-10-19-18(22)23-13-7-5-6-12(11-13)16(21)17-20-14-8-3-4-9-15(14)24-17/h3-9,11H,2,10H2,1H3,(H,19,22)
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n/an/a 143n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218949
PNG
(3-(benzo[d]oxazole-2-carbonyl)phenyl benzylcarbama...)
Show SMILES O=C(NCc1ccccc1)Oc1cccc(c1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C22H16N2O4/c25-20(21-24-18-11-4-5-12-19(18)28-21)16-9-6-10-17(13-16)27-22(26)23-14-15-7-2-1-3-8-15/h1-13H,14H2,(H,23,26)
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n/an/a 152n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218946
PNG
(3-(benzo[d]thiazole-2-carbonyl)phenyl ethylcarbama...)
Show SMILES CCNC(=O)Oc1cccc(c1)C(=O)c1nc2ccccc2s1
Show InChI InChI=1S/C17H14N2O3S/c1-2-18-17(21)22-12-7-5-6-11(10-12)15(20)16-19-13-8-3-4-9-14(13)23-16/h3-10H,2H2,1H3,(H,18,21)
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n/an/a 238n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218947
PNG
(4-(benzo[d]oxazole-2-carbonyl)phenyl cyclopentylca...)
Show SMILES O=C(NC1CCCC1)Oc1ccc(cc1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C20H18N2O4/c23-18(19-22-16-7-3-4-8-17(16)26-19)13-9-11-15(12-10-13)25-20(24)21-14-5-1-2-6-14/h3-4,7-12,14H,1-2,5-6H2,(H,21,24)
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n/an/a 288n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50218948
PNG
(3-(benzo[d]oxazole-2-carbonyl)phenyl ethylcarbamat...)
Show SMILES CCNC(=O)Oc1cccc(c1)C(=O)c1nc2ccccc2o1
Show InChI InChI=1S/C17H14N2O4/c1-2-18-17(21)22-12-7-5-6-11(10-12)15(20)16-19-13-8-3-4-9-14(13)23-16/h3-10H,2H2,1H3,(H,18,21)
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n/an/a 379n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH activity in Wistar rat brain


J Med Chem 50: 4236-42 (2007)


Article DOI: 10.1021/jm070501w
BindingDB Entry DOI: 10.7270/Q2DV1JKK
More data for this
Ligand-Target Pair