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Compile Data Set for Download or QSAR

Found 47 hits from Helsinki University of Technology   
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 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298655
PNG
(3-(4,5-Dihydrooxazol-2-yl)phenyl cyclohexylcarbama...)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(c1)C1=NCCO1 |t:18|
Show InChI InChI=1S/C16H20N2O3/c19-16(18-13-6-2-1-3-7-13)21-14-8-4-5-12(11-14)15-17-9-10-20-15/h4-5,8,11,13H,1-3,6-7,9-10H2,(H,18,19)
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n/an/a 1.20n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298666
PNG
((S)-3-(5-Methyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES C[C@H]1CN=C(O1)c1cccc(OC(=O)NC2CCCCC2)c1 |r,c:3|
Show InChI InChI=1S/C17H22N2O3/c1-12-11-18-16(21-12)13-6-5-9-15(10-13)22-17(20)19-14-7-3-2-4-8-14/h5-6,9-10,12,14H,2-4,7-8,11H2,1H3,(H,19,20)/t12-/m0/s1
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n/an/a 6.80n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298664
PNG
((S)-Methyl 2-(3-(cyclohexylcarbamoyloxy)phenyl)-4,...)
Show SMILES COC(=O)[C@@H]1COC(=N1)c1cccc(OC(=O)NC2CCCCC2)c1 |r,c:7|
Show InChI InChI=1S/C18H22N2O5/c1-23-17(21)15-11-24-16(20-15)12-6-5-9-14(10-12)25-18(22)19-13-7-3-2-4-8-13/h5-6,9-10,13,15H,2-4,7-8,11H2,1H3,(H,19,22)/t15-/m0/s1
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n/an/a 9.40n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298654
PNG
(3-(4,5-Dihydrooxazol-2-yl)phenyl cyclopentylcarbam...)
Show SMILES O=C(NC1CCCC1)Oc1cccc(c1)C1=NCCO1 |t:17|
Show InChI InChI=1S/C15H18N2O3/c18-15(17-12-5-1-2-6-12)20-13-7-3-4-11(10-13)14-16-8-9-19-14/h3-4,7,10,12H,1-2,5-6,8-9H2,(H,17,18)
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n/an/a 13n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298660
PNG
((R)-3-(4-Methyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES C[C@@H]1COC(=N1)c1cccc(OC(=O)NC2CCCCC2)c1 |r,c:4|
Show InChI InChI=1S/C17H22N2O3/c1-12-11-21-16(18-12)13-6-5-9-15(10-13)22-17(20)19-14-7-3-2-4-8-14/h5-6,9-10,12,14H,2-4,7-8,11H2,1H3,(H,19,20)/t12-/m1/s1
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n/an/a 16n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
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))
BDBM50298653
PNG
(3-(4,5-Dihydrooxazol-2-yl)phenyl propylcarbamate |...)
Show SMILES CCCNC(=O)Oc1cccc(c1)C1=NCCO1 |t:14|
Show InChI InChI=1S/C13H16N2O3/c1-2-6-15-13(16)18-11-5-3-4-10(9-11)12-14-7-8-17-12/h3-5,9H,2,6-8H2,1H3,(H,15,16)
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n/an/a 33n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
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))
BDBM50298657
PNG
(3-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES CC1(C)COC(=N1)c1cccc(OC(=O)NC2CCCCC2)c1 |c:5|
Show InChI InChI=1S/C18H24N2O3/c1-18(2)12-22-16(20-18)13-7-6-10-15(11-13)23-17(21)19-14-8-4-3-5-9-14/h6-7,10-11,14H,3-5,8-9,12H2,1-2H3,(H,19,21)
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n/an/a 46n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
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))
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))
BDBM50298659
PNG
((S)-3-(4-Methyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES C[C@H]1COC(=N1)c1cccc(OC(=O)NC2CCCCC2)c1 |r,c:4|
Show InChI InChI=1S/C17H22N2O3/c1-12-11-21-16(18-12)13-6-5-9-15(10-13)22-17(20)19-14-7-3-2-4-8-14/h5-6,9-10,12,14H,2-4,7-8,11H2,1H3,(H,19,20)/t12-/m0/s1
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n/an/a 51n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
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))
BDBM50298656
PNG
(3-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)phenyl cycl...)
Show SMILES CC1(C)COC(=N1)c1cccc(OC(=O)NC2CCCC2)c1 |c:5|
Show InChI InChI=1S/C17H22N2O3/c1-17(2)11-21-15(19-17)12-6-5-9-14(10-12)22-16(20)18-13-7-3-4-8-13/h5-6,9-10,13H,3-4,7-8,11H2,1-2H3,(H,18,20)
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n/an/a 65n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298665
PNG
((R)-3-(5-Methyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES C[C@@H]1CN=C(O1)c1cccc(OC(=O)NC2CCCCC2)c1 |r,c:3|
Show InChI InChI=1S/C17H22N2O3/c1-12-11-18-16(21-12)13-6-5-9-15(10-13)22-17(20)19-14-7-3-2-4-8-14/h5-6,9-10,12,14H,2-4,7-8,11H2,1H3,(H,19,20)/t12-/m1/s1
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n/an/a 73n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298663
PNG
((R)-Methyl 2-(3-(cyclohexylcarbamoyloxy)phenyl)-4,...)
Show SMILES COC(=O)[C@H]1COC(=N1)c1cccc(OC(=O)NC2CCCCC2)c1 |r,c:7|
Show InChI InChI=1S/C18H22N2O5/c1-23-17(21)15-11-24-16(20-15)12-6-5-9-14(10-12)25-18(22)19-13-7-3-2-4-8-13/h5-6,9-10,13,15H,2-4,7-8,11H2,1H3,(H,19,22)/t15-/m1/s1
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n/an/a 90n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
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))
BDBM50298658
PNG
((S)-3-(4-Methyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES C[C@H]1COC(=N1)c1cccc(OC(=O)NC2CCCC2)c1 |r,c:4|
Show InChI InChI=1S/C16H20N2O3/c1-11-10-20-15(17-11)12-5-4-8-14(9-12)21-16(19)18-13-6-2-3-7-13/h4-5,8-9,11,13H,2-3,6-7,10H2,1H3,(H,18,19)/t11-/m0/s1
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n/an/a 110n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
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
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298662
PNG
((R)-3-(4-Benzyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(c1)C1=N[C@H](Cc2ccccc2)CO1 |r,t:18|
Show InChI InChI=1S/C23H26N2O3/c26-23(25-19-11-5-2-6-12-19)28-21-13-7-10-18(15-21)22-24-20(16-27-22)14-17-8-3-1-4-9-17/h1,3-4,7-10,13,15,19-20H,2,5-6,11-12,14,16H2,(H,25,26)/t20-/m1/s1
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n/an/a 590n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298651
PNG
(3-(Oxazolo[4,5-b]pyridin-2-yl)phenyl propylcarbama...)
Show SMILES CCCNC(=O)Oc1cccc(c1)-c1nc2ncccc2o1
Show InChI InChI=1S/C16H15N3O3/c1-2-8-18-16(20)21-12-6-3-5-11(10-12)15-19-14-13(22-15)7-4-9-17-14/h3-7,9-10H,2,8H2,1H3,(H,18,20)
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n/an/a 680n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298667
PNG
((S)-3-(4-((1H-Indol-3-yl)methyl)-4,5-dihydrooxazol...)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(c1)C1=N[C@@H](Cc2c[nH]c3ccccc23)CO1 |r,t:18|
Show InChI InChI=1S/C25H27N3O3/c29-25(28-19-8-2-1-3-9-19)31-21-10-6-7-17(14-21)24-27-20(16-30-24)13-18-15-26-23-12-5-4-11-22(18)23/h4-7,10-12,14-15,19-20,26H,1-3,8-9,13,16H2,(H,28,29)/t20-/m0/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298661
PNG
((S)-3-(4-Benzyl-4,5-dihydrooxazol-2-yl)phenylcyclo...)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(c1)C1=N[C@@H](Cc2ccccc2)CO1 |r,t:18|
Show InChI InChI=1S/C23H26N2O3/c26-23(25-19-11-5-2-6-12-19)28-21-13-7-10-18(15-21)22-24-20(16-27-22)14-17-8-3-1-4-9-17/h1,3-4,7-10,13,15,19-20H,2,5-6,11-12,14,16H2,(H,25,26)/t20-/m0/s1
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n/an/a 2.10E+3n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298650
PNG
(3-(benzo[d]oxazol-2-yl)phenyl propylcarbamate | CH...)
Show SMILES CCCNC(=O)Oc1cccc(c1)-c1nc2ccccc2o1
Show InChI InChI=1S/C17H16N2O3/c1-2-10-18-17(20)21-13-7-5-6-12(11-13)16-19-14-8-3-4-9-15(14)22-16/h3-9,11H,2,10H2,1H3,(H,18,20)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM50298652
PNG
(3-(Oxazolo[4,5-d]pyrimidin-2-yl)phenyl propylcarba...)
Show SMILES CCCNC(=O)Oc1cccc(c1)-c1nc2ncncc2o1
Show InChI InChI=1S/C15H14N4O3/c1-2-6-17-15(20)21-11-5-3-4-10(7-11)14-19-13-12(22-14)8-16-9-18-13/h3-5,7-9H,2,6H2,1H3,(H,17,20)
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n/an/a 4.50E+3n/an/an/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Inhibition of FAAH in Wistar rat brain assessed as by liquid scintillation counting


Eur J Med Chem 44: 4179-91 (2009)


Article DOI: 10.1016/j.ejmech.2009.05.012
BindingDB Entry DOI: 10.7270/Q2FT8M3R
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414526
PNG
(CHEMBL550186)
Show SMILES CN(C)c1ccccc1C(=O)c1ccc2ccccc2n1
Show InChI InChI=1S/C18H16N2O/c1-20(2)17-10-6-4-8-14(17)18(21)16-12-11-13-7-3-5-9-15(13)19-16/h3-12H,1-2H3
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n/an/an/an/a 794n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414525
PNG
(CHEMBL551670)
Show SMILES Clc1ccc(cc1)C(=O)c1ccc2ccccc2n1
Show InChI InChI=1S/C16H10ClNO/c17-13-8-5-12(6-9-13)16(19)15-10-7-11-3-1-2-4-14(11)18-15/h1-10H
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n/an/an/an/a 3.98E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414524
PNG
(CHEMBL537950)
Show SMILES FC(F)(F)c1ccc(cc1)C(=O)c1nccc2ccccc12
Show InChI InChI=1S/C17H10F3NO/c18-17(19,20)13-7-5-12(6-8-13)16(22)15-14-4-2-1-3-11(14)9-10-21-15/h1-10H
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n/an/an/an/a 3.16E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414523
PNG
(CHEMBL552333)
Show SMILES FC(F)(F)c1ccccc1C(=O)c1nccc2ccccc12
Show InChI InChI=1S/C17H10F3NO/c18-17(19,20)14-8-4-3-7-13(14)16(22)15-12-6-2-1-5-11(12)9-10-21-15/h1-10H
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n/an/an/an/a 501n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414522
PNG
(CHEMBL224137)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)c1nccc2ccccc12
Show InChI InChI=1S/C17H10F3NO/c18-17(19,20)13-6-3-5-12(10-13)16(22)15-14-7-2-1-4-11(14)8-9-21-15/h1-10H
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n/an/an/an/a 5.01E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414521
PNG
(CHEMBL549504)
Show SMILES CN(C)c1ccccc1C(=O)c1nccc2ccccc12
Show InChI InChI=1S/C18H16N2O/c1-20(2)16-10-6-5-9-15(16)18(21)17-14-8-4-3-7-13(14)11-12-19-17/h3-12H,1-2H3
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n/an/an/an/a 631n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414520
PNG
(CHEMBL559675)
Show SMILES CN(C)c1ccc(cc1)C(=O)c1nccc2ccccc12
Show InChI InChI=1S/C18H16N2O/c1-20(2)15-9-7-14(8-10-15)18(21)17-16-6-4-3-5-13(16)11-12-19-17/h3-12H,1-2H3
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n/an/an/an/a 2.51E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414519
PNG
(CHEMBL552477)
Show SMILES O=C(c1ccccc1)c1ccc2ccccc2n1
Show InChI InChI=1S/C16H11NO/c18-16(13-7-2-1-3-8-13)15-11-10-12-6-4-5-9-14(12)17-15/h1-11H
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n/an/an/an/a 7.94E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414518
PNG
(CHEMBL558255)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)c1ccc2ccccc2n1
Show InChI InChI=1S/C17H10F3NO/c18-17(19,20)13-6-3-5-12(10-13)16(22)15-9-8-11-4-1-2-7-14(11)21-15/h1-10H
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n/an/an/an/a 5.01E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414517
PNG
(CHEMBL564933)
Show SMILES FC(F)(F)c1ccccc1C(=O)c1ccc2ccccc2n1
Show InChI InChI=1S/C17H10F3NO/c18-17(19,20)13-7-3-2-6-12(13)16(22)15-10-9-11-5-1-4-8-14(11)21-15/h1-10H
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n/an/an/an/a 2.00E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414516
PNG
(CHEMBL181044)
Show SMILES COc1cccc(c1)C(=O)c1ccc2ccccc2n1
Show InChI InChI=1S/C17H13NO2/c1-20-14-7-4-6-13(11-14)17(19)16-10-9-12-5-2-3-8-15(12)18-16/h2-11H,1H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414515
PNG
(CHEMBL558648)
Show SMILES COc1ccccc1C(=O)c1ccc2ccccc2n1
Show InChI InChI=1S/C17H13NO2/c1-20-16-9-5-3-7-13(16)17(19)15-11-10-12-6-2-4-8-14(12)18-15/h2-11H,1H3
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n/an/an/an/a 2.51E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50414527
PNG
(CHEMBL556844)
Show SMILES CN(C)c1ccc(cc1)C(=O)c1ccc2ccccc2n1
Show InChI InChI=1S/C18H16N2O/c1-20(2)15-10-7-14(8-11-15)18(21)17-12-9-13-5-3-4-6-16(13)19-17/h3-12H,1-2H3
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n/an/an/an/a 6.31E+3n/an/an/an/a



Helsinki University of Technology

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cells by [35]GTPgammaS binding assay


Bioorg Med Chem 17: 4441-7 (2009)


Article DOI: 10.1016/j.bmc.2009.05.013
BindingDB Entry DOI: 10.7270/Q24X5917
More data for this
Ligand-Target Pair