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PubMed code 16892344

Compile data set for download or QSAR
Found 13 hits of Enzyme Inhibition Constant Data   
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
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97458
PNG
(FAAH Inhibitor, 2g)
Show SMILES Oc1ccc(OC(=O)NC2CCCCC2)cc1-c1ccccc1
Show InChI InChI=1S/C19H21NO3/c21-18-12-11-16(13-17(18)14-7-3-1-4-8-14)23-19(22)20-15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15,21H,2,5-6,9-10H2,(H,20,22)
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Article
PubMed
n/an/a 45n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97459
PNG
(FAAH Inhibitor, 2h)
Show SMILES OCc1ccc(OC(=O)NC2CCCCC2)cc1-c1ccccc1
Show InChI InChI=1S/C20H23NO3/c22-14-16-11-12-18(13-19(16)15-7-3-1-4-8-15)24-20(23)21-17-9-5-2-6-10-17/h1,3-4,7-8,11-13,17,22H,2,5-6,9-10,14H2,(H,21,23)
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n/an/a 46n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97455
PNG
(FAAH Inhibitor, 2d)
Show SMILES Nc1ccc(OC(=O)NC2CCCCC2)cc1-c1ccccc1
Show InChI InChI=1S/C19H22N2O2/c20-18-12-11-16(13-17(18)14-7-3-1-4-8-14)23-19(22)21-15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15H,2,5-6,9-10,20H2,(H,21,22)
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n/an/a 52n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM50128585
PNG
(CHEMBL431202 | Cyclohexyl-carbamic acid biphenyl-3...)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C19H21NO2/c21-19(20-17-11-5-2-6-12-17)22-18-13-7-10-16(14-18)15-8-3-1-4-9-15/h1,3-4,7-10,13-14,17H,2,5-6,11-12H2,(H,20,21)
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n/an/a 63n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97457
PNG
(FAAH Inhibitor, 2f)
Show SMILES Cc1ccc(OC(=O)NC2CCCCC2)cc1-c1ccccc1
Show InChI InChI=1S/C20H23NO2/c1-15-12-13-18(14-19(15)16-8-4-2-5-9-16)23-20(22)21-17-10-6-3-7-11-17/h2,4-5,8-9,12-14,17H,3,6-7,10-11H2,1H3,(H,21,22)
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n/an/a 176n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97456
PNG
(FAAH Inhibitor, 2e)
Show SMILES NC(=O)c1ccc(OC(=O)NC2CCCCC2)cc1-c1ccccc1
Show InChI InChI=1S/C20H22N2O3/c21-19(23)17-12-11-16(13-18(17)14-7-3-1-4-8-14)25-20(24)22-15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15H,2,5-6,9-10H2,(H2,21,23)(H,22,24)
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n/an/a 252n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97462
PNG
(FAAH Inhibitor, 2k)
Show SMILES O=C(NC1CCCCC1)Oc1ccc2ccn(-c3ccccc3)c2c1
Show InChI InChI=1S/C21H22N2O2/c24-21(22-17-7-3-1-4-8-17)25-19-12-11-16-13-14-23(20(16)15-19)18-9-5-2-6-10-18/h2,5-6,9-15,17H,1,3-4,7-8H2,(H,22,24)
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n/an/a 1.03E+3n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97460
PNG
(FAAH Inhibitor, 2i)
Show SMILES CN(C)c1ccc(OC(=O)NC2CCCCC2)cc1-c1ccccc1
Show InChI InChI=1S/C21H26N2O2/c1-23(2)20-14-13-18(15-19(20)16-9-5-3-6-10-16)25-21(24)22-17-11-7-4-8-12-17/h3,5-6,9-10,13-15,17H,4,7-8,11-12H2,1-2H3,(H,22,24)
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n/an/a 1.59E+3n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97463
PNG
(FAAH Inhibitor, 2l)
Show SMILES O=C(NC1CCCCC1)Oc1cccc(Oc2cccc(c2)-c2ccccc2)c1
Show InChI InChI=1S/C25H25NO3/c27-25(26-21-12-5-2-6-13-21)29-24-16-8-15-23(18-24)28-22-14-7-11-20(17-22)19-9-3-1-4-10-19/h1,3-4,7-11,14-18,21H,2,5-6,12-13H2,(H,26,27)
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n/an/a 2.74E+3n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97461
PNG
(FAAH Inhibitor, 2j)
Show SMILES O=C(NC1CCCCC1)NC(=O)c1ccc(OC(=O)NC2CCCCC2)cc1-c1ccccc1
Show InChI InChI=1S/C27H33N3O4/c31-25(30-26(32)28-20-12-6-2-7-13-20)23-17-16-22(18-24(23)19-10-4-1-5-11-19)34-27(33)29-21-14-8-3-9-15-21/h1,4-5,10-11,16-18,20-21H,2-3,6-9,12-15H2,(H,29,33)(H2,28,30,31,32)
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n/an/a 2.74E+3n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97453
PNG
(FAAH Inhibitor, 2b)
Show SMILES Nc1ccc(cc1OC(=O)NC1CCCCC1)-c1ccccc1
Show InChI InChI=1S/C19H22N2O2/c20-17-12-11-15(14-7-3-1-4-8-14)13-18(17)23-19(22)21-16-9-5-2-6-10-16/h1,3-4,7-8,11-13,16H,2,5-6,9-10,20H2,(H,21,22)
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n/an/a 4.83E+3n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97454
PNG
(FAAH Inhibitor, 2c)
Show SMILES O=C(NC1CCCCC1)Oc1ccc(c(c1)-c1ccccc1)N(=O)=O
Show InChI InChI=1S/C19H20N2O4/c22-19(20-15-9-5-2-6-10-15)25-16-11-12-18(21(23)24)17(13-16)14-7-3-1-4-8-14/h1,3-4,7-8,11-13,15H,2,5-6,9-10H2,(H,20,22)
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n/an/a>3.00E+4n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM97452
PNG
(FAAH Inhibitor, 2a)
Show SMILES O=C(NC1CCCCC1)Oc1cc(ccc1N(=O)=O)-c1ccccc1
Show InChI InChI=1S/C19H20N2O4/c22-19(20-16-9-5-2-6-10-16)25-18-13-15(11-12-17(18)21(23)24)14-7-3-1-4-8-14/h1,3-4,7-8,11-13,16H,2,5-6,9-10H2,(H,20,22)
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n/an/a>3.00E+4n/an/an/an/an/an/a



UniversitÓ degli Studi di Parma



Assay Description
Membrane fractions were prepared from Wistar rat brain homogenates, and FAAH activity were assayed by using [3H]anandamide (anandamide[ethanolamine-3...


ChemMedChem 1: 130-9 (2006)


Article DOI: 10.1002/cmdc.200500017
BindingDB Entry DOI: 10.7270/Q2XG9PRC
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%