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Compile Data Set for Download or QSAR

Found 1514 hits with Last Name = 'van der stelt' and Initial = 'm'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sn1-specific diacylglycerol lipase alpha


(Mus musculus)
BDBM50519345
PNG
(CHEMBL4447844)
Show SMILES Cc1ccc(cc1)-c1cnc2nc(oc2c1)C(=O)CCCCCc1ccccc1
Show InChI InChI=1S/C25H24N2O2/c1-18-12-14-20(15-13-18)21-16-23-24(26-17-21)27-25(29-23)22(28)11-7-3-6-10-19-8-4-2-5-9-19/h2,4-5,8-9,12-17H,3,6-7,10-11H2,1H3
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0.230n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of mouse DAGL-alpha expressed in HEK293T cell membranes assessed as inhibition constant pre-incubated for 20 mins before PNP-butyrate subs...


J Med Chem 62: 7910-7922 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00686
More data for this
Ligand-Target Pair
Sn1-specific diacylglycerol lipase alpha


(Mus musculus)
BDBM50211257
PNG
(CHEMBL3895863 | US10583137, Compound 14)
Show SMILES OC(c1cnn(n1)C(=O)N1C[C@@H](CC[C@@H]1Cc1ccccc1)OCC#C)(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C31H28F2N4O3/c1-2-18-40-28-17-16-27(19-22-6-4-3-5-7-22)36(21-28)30(38)37-34-20-29(35-37)31(39,23-8-12-25(32)13-9-23)24-10-14-26(33)15-11-24/h1,3-15,20,27-28,39H,16-19,21H2/t27-,28-/m1/s1
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0.270n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of mouse DAGL-alpha expressed in HEK293T cell membranes assessed as inhibition constant pre-incubated for 20 mins before PNP-butyrate subs...


J Med Chem 62: 7910-7922 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00686
More data for this
Ligand-Target Pair
Sn1-specific diacylglycerol lipase alpha


(Mus musculus)
BDBM50211236
PNG
(CHEMBL2144065)
Show SMILES O=C(N1CCCCC1Cc1ccccc1)n1cc(nn1)-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H26N4O/c32-27(30-18-8-7-13-25(30)19-21-9-3-1-4-10-21)31-20-26(28-29-31)24-16-14-23(15-17-24)22-11-5-2-6-12-22/h1-6,9-12,14-17,20,25H,7-8,13,18-19H2
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0.350n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of mouse DAGL-alpha expressed in HEK293T cell membranes assessed as inhibition constant pre-incubated for 20 mins before PNP-butyrate subs...


J Med Chem 62: 7910-7922 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00686
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368791
PNG
(CHEMBL4171931)
Show SMILES Nc1nc(NCCCCCNC(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C20H21FN8O4S/c21-34(31,32)14-8-6-13(7-9-14)17(30)23-10-2-1-3-11-24-19-26-18(22)29-20(27-19)25-16(28-29)15-5-4-12-33-15/h4-9,12H,1-3,10-11H2,(H,23,30)(H3,22,24,25,26,27,28)
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0.617n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 3 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368789
PNG
(CHEMBL4164058)
Show SMILES Nc1nc(NCCCCNC(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C19H19FN8O4S/c20-33(30,31)13-7-5-12(6-8-13)16(29)22-9-1-2-10-23-18-25-17(21)28-19(26-18)24-15(27-28)14-4-3-11-32-14/h3-8,11H,1-2,9-10H2,(H,22,29)(H3,21,23,24,25,26,27)
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0.891n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 3 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368790
PNG
(CHEMBL4159904)
Show SMILES Nc1nc(NCCCNC(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C18H17FN8O4S/c19-32(29,30)12-6-4-11(5-7-12)15(28)21-8-2-9-22-17-24-16(20)27-18(25-17)23-14(26-27)13-3-1-10-31-13/h1,3-7,10H,2,8-9H2,(H,21,28)(H3,20,22,23,24,25,26)
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1n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 3 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368792
PNG
(CHEMBL4167502)
Show SMILES Nc1nc(NCCCCCN(CC#C)C(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C23H23FN8O4S/c1-2-13-31(20(33)16-8-10-17(11-9-16)37(24,34)35)14-5-3-4-12-26-22-28-21(25)32-23(29-22)27-19(30-32)18-7-6-15-36-18/h1,6-11,15H,3-5,12-14H2,(H3,25,26,27,28,29,30)
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1.5n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 3 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368791
PNG
(CHEMBL4171931)
Show SMILES Nc1nc(NCCCCCNC(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C20H21FN8O4S/c21-34(31,32)14-8-6-13(7-9-14)17(30)23-10-2-1-3-11-24-19-26-18(22)29-20(27-19)25-16(28-29)15-5-4-12-33-15/h4-9,12H,1-3,10-11H2,(H,23,30)(H3,22,24,25,26,27,28)
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2.80n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 0.5 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368792
PNG
(CHEMBL4167502)
Show SMILES Nc1nc(NCCCCCN(CC#C)C(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C23H23FN8O4S/c1-2-13-31(20(33)16-8-10-17(11-9-16)37(24,34)35)14-5-3-4-12-26-22-28-21(25)32-23(29-22)27-19(30-32)18-7-6-15-36-18/h1,6-11,15H,3-5,12-14H2,(H3,25,26,27,28,29,30)
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3.90n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 0.5 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368790
PNG
(CHEMBL4159904)
Show SMILES Nc1nc(NCCCNC(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C18H17FN8O4S/c19-32(29,30)12-6-4-11(5-7-12)15(28)21-8-2-9-22-17-24-16(20)27-18(25-17)23-14(26-27)13-3-1-10-31-13/h1,3-7,10H,2,8-9H2,(H,21,28)(H3,20,22,23,24,25,26)
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5.40n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 0.5 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM50368789
PNG
(CHEMBL4164058)
Show SMILES Nc1nc(NCCCCNC(=O)c2ccc(cc2)S(F)(=O)=O)nc2nc(nn12)-c1ccco1
Show InChI InChI=1S/C19H19FN8O4S/c20-33(30,31)13-7-5-12(6-8-13)16(29)22-9-1-2-10-23-18-25-17(21)28-19(26-18)24-15(27-28)14-4-3-11-32-14/h3-8,11H,1-2,9-10H2,(H,22,29)(H3,21,23,24,25,26,27)
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6.30n/an/an/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 human A2AR (1 to 316 residues) expressed in Pichia pastoris SMD1168 cell membranes incubated for 0.5 hrs


J Med Chem 61: 7892-7901 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00860
BindingDB Entry DOI: 10.7270/Q2RF5XJ5
More data for this
Ligand-Target Pair
Sn1-specific diacylglycerol lipase alpha


(Mus musculus)
BDBM50211265
PNG
(CHEMBL3954476)
Show SMILES OC(c1cnn(n1)C(=O)N1CCCC[C@@H]1Cc1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C28H26F2N4O2/c29-23-13-9-21(10-14-23)28(36,22-11-15-24(30)16-12-22)26-19-31-34(32-26)27(35)33-17-5-4-8-25(33)18-20-6-2-1-3-7-20/h1-3,6-7,9-16,19,25,36H,4-5,8,17-18H2/t25-/m1/s1
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10n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of mouse DAGL-alpha expressed in HEK293T cell membranes assessed as inhibition constant pre-incubated for 20 mins before PNP-butyrate subs...


J Med Chem 62: 7910-7922 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00686
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM22988
PNG
((5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)icosa-5,8,11,14-...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-21H2,1H3,(H,23,25)/b7-6-,10-9-,13-12-,16-15-
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90n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM26144
PNG
(1,3-dihydroxypropan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC(CO)CO
Show InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-22(20-24)21-25/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-
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100n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM26144
PNG
(1,3-dihydroxypropan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC(CO)CO
Show InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-22(20-24)21-25/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-
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100n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117245
PNG
(12-Hydroxy-icosa-5,8,10,14-tetraenoic acid (2-hydr...)
Show SMILES CCCCC\C=C/C[C@@H](O)\C=C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-10-13-16-21(25)17-14-11-8-6-7-9-12-15-18-22(26)23-19-20-24/h7-11,13-14,17,21,24-25H,2-6,12,15-16,18-20H2,1H3,(H,23,26)/b9-7-,11-8-,13-10-,17-14+/t21-/m1/s1
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150n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Sn1-specific diacylglycerol lipase alpha


(Mus musculus)
BDBM50519341
PNG
(CHEMBL4437021)
Show SMILES OC(c1cn(nn1)C(=O)N1CCCC[C@@H]1Cc1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1
Show InChI InChI=1S/C28H26F2N4O2/c29-23-13-9-21(10-14-23)28(36,22-11-15-24(30)16-12-22)26-19-34(32-31-26)27(35)33-17-5-4-8-25(33)18-20-6-2-1-3-7-20/h1-3,6-7,9-16,19,25,36H,4-5,8,17-18H2/t25-/m1/s1
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339n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of mouse DAGL-alpha expressed in HEK293T cell membranes assessed as inhibition constant pre-incubated for 20 mins before PNP-butyrate subs...


J Med Chem 62: 7910-7922 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00686
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM22988
PNG
((5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)icosa-5,8,11,14-...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-21H2,1H3,(H,23,25)/b7-6-,10-9-,13-12-,16-15-
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360n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Homo sapiens (Human))
BDBM50117251
PNG
(13-Hydroxy-octadeca-9,11-dienoic acid (2-hydroxy-e...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/CCCCCCCC(=O)NCCO
Show InChI InChI=1S/C20H37NO3/c1-2-3-11-14-19(23)15-12-9-7-5-4-6-8-10-13-16-20(24)21-17-18-22/h7,9,12,15,19,22-23H,2-6,8,10-11,13-14,16-18H2,1H3,(H,21,24)/b9-7-,15-12+/t19-/m0/s1
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430n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117245
PNG
(12-Hydroxy-icosa-5,8,10,14-tetraenoic acid (2-hydr...)
Show SMILES CCCCC\C=C/C[C@@H](O)\C=C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-10-13-16-21(25)17-14-11-8-6-7-9-12-15-18-22(26)23-19-20-24/h7-11,13-14,17,21,24-25H,2-6,12,15-16,18-20H2,1H3,(H,23,26)/b9-7-,11-8-,13-10-,17-14+/t21-/m1/s1
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500n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117256
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid 2,3-dih...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@@H](O)CO
Show InChI InChI=1S/C23H38O5/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-23(27)28-20-22(26)19-24/h4-5,8-11,14,17,21-22,24-26H,2-3,6-7,12-13,15-16,18-20H2,1H3/b5-4-,10-8-,11-9-,17-14+/t21-,22-/m0/s1
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550n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Homo sapiens (Human))
BDBM50117247
PNG
(11-Hydroxy-icosa-5,8,12,14-tetraenoic acid (2-hydr...)
Show SMILES CCCCC\C=C/C=C/[C@@H](O)C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-7-10-13-16-21(25)17-14-11-8-6-9-12-15-18-22(26)23-19-20-24/h6-7,9-11,13-14,16,21,24-25H,2-5,8,12,15,17-20H2,1H3,(H,23,26)/b9-6-,10-7-,14-11-,16-13+/t21-/m1/s1
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570n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117251
PNG
(13-Hydroxy-octadeca-9,11-dienoic acid (2-hydroxy-e...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/CCCCCCCC(=O)NCCO
Show InChI InChI=1S/C20H37NO3/c1-2-3-11-14-19(23)15-12-9-7-5-4-6-8-10-13-16-20(24)21-17-18-22/h7,9,12,15,19,22-23H,2-6,8,10-11,13-14,16-18H2,1H3,(H,21,24)/b9-7-,15-12+/t19-/m0/s1
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600n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117252
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid (2-hydr...)
Show SMILES CCCCC[C@@H](O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-22(26)23-19-20-24/h4-5,8-11,14,17,21,24-25H,2-3,6-7,12-13,15-16,18-20H2,1H3,(H,23,26)/b5-4-,10-8-,11-9-,17-14+/t21-/m1/s1
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600n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Homo sapiens (Human))
BDBM50117252
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid (2-hydr...)
Show SMILES CCCCC[C@@H](O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-22(26)23-19-20-24/h4-5,8-11,14,17,21,24-25H,2-3,6-7,12-13,15-16,18-20H2,1H3,(H,23,26)/b5-4-,10-8-,11-9-,17-14+/t21-/m1/s1
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630n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Homo sapiens (Human))
BDBM50117250
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid (2-hydr...)
Show SMILES CCCCCC(O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-22(26)23-19-20-24/h4-5,8-11,14,17,21,24-25H,2-3,6-7,12-13,15-16,18-20H2,1H3,(H,23,26)/b5-4-,10-8-,11-9-,17-14+
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630n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117250
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid (2-hydr...)
Show SMILES CCCCCC(O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-22(26)23-19-20-24/h4-5,8-11,14,17,21,24-25H,2-3,6-7,12-13,15-16,18-20H2,1H3,(H,23,26)/b5-4-,10-8-,11-9-,17-14+
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680n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117255
PNG
(5-Hydroxy-icosa-6,8,11,14-tetraenoic acid (2-hydro...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C=C/[C@@H](O)CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-21(25)17-15-18-22(26)23-19-20-24/h6-7,9-10,12-14,16,21,24-25H,2-5,8,11,15,17-20H2,1H3,(H,23,26)/b7-6-,10-9-,13-12-,16-14+/t21-/m1/s1
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680n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Homo sapiens (Human))
BDBM50117254
PNG
(11-Hydroxy-icosa-5,8,12,14-tetraenoic acid (2-hydr...)
Show SMILES CCCCC\C=C/C=C/C(O)C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-7-10-13-16-21(25)17-14-11-8-6-9-12-15-18-22(26)23-19-20-24/h6-7,9-11,13-14,16,21,24-25H,2-5,8,12,15,17-20H2,1H3,(H,23,26)/b9-6-,10-7-,14-11-,16-13+
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690n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Homo sapiens (Human))
BDBM50117243
PNG
(8,15-Dihydroxy-icosa-5,9,11,13-tetraenoic acid (2-...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/C=C/[C@@H](O)C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO4/c1-2-3-8-13-20(25)14-9-4-5-10-15-21(26)16-11-6-7-12-17-22(27)23-18-19-24/h4-6,9-11,14-15,20-21,24-26H,2-3,7-8,12-13,16-19H2,1H3,(H,23,27)/b5-4-,11-6-,14-9+,15-10+/t20-,21+/m0/s1
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690n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Sn1-specific diacylglycerol lipase alpha


(Homo sapiens (Human))
BDBM50048620
PNG
(CHEMBL3319620)
Show SMILES CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(CC(O)=O)Cc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C26H27NO6S/c1-26(2)15-14-20-16-23(12-13-24(20)33-26)34(30,31)27(18-25(28)29)17-19-8-10-22(11-9-19)32-21-6-4-3-5-7-21/h3-13,16H,14-15,17-18H2,1-2H3,(H,28,29)
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700n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of human DAGLalpha expressed in HEK293T cell membranes assessed as reduction in hydrolysis of inhibition of [14C]-sn-1-oleoyl-2-arachidono...


J Med Chem 57: 6610-22 (2014)


Article DOI: 10.1021/jm500681z
BindingDB Entry DOI: 10.7270/Q2R49SD4
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117255
PNG
(5-Hydroxy-icosa-6,8,11,14-tetraenoic acid (2-hydro...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C=C/[C@@H](O)CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-21(25)17-15-18-22(26)23-19-20-24/h6-7,9-10,12-14,16,21,24-25H,2-5,8,11,15,17-20H2,1H3,(H,23,26)/b7-6-,10-9-,13-12-,16-14+/t21-/m1/s1
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710n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Monoacylglycerol lipase ABHD6


(Homo sapiens (Human))
BDBM50048620
PNG
(CHEMBL3319620)
Show SMILES CC1(C)CCc2cc(ccc2O1)S(=O)(=O)N(CC(O)=O)Cc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C26H27NO6S/c1-26(2)15-14-20-16-23(12-13-24(20)33-26)34(30,31)27(18-25(28)29)17-19-8-10-22(11-9-19)32-21-6-4-3-5-7-21/h3-13,16H,14-15,17-18H2,1-2H3,(H,28,29)
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800n/an/an/an/an/an/an/an/a



Leiden University

Curated by ChEMBL


Assay Description
Inhibition of human ABHD6 expressed in HEK293T cell membranes assessed as reduction in glycerol production using 2-arachidonoyl glycerol substrate


J Med Chem 57: 6610-22 (2014)


Article DOI: 10.1021/jm500681z
BindingDB Entry DOI: 10.7270/Q2R49SD4
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117243
PNG
(8,15-Dihydroxy-icosa-5,9,11,13-tetraenoic acid (2-...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/C=C/[C@@H](O)C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO4/c1-2-3-8-13-20(25)14-9-4-5-10-15-21(26)16-11-6-7-12-17-22(27)23-18-19-24/h4-6,9-11,14-15,20-21,24-26H,2-3,7-8,12-13,16-19H2,1H3,(H,23,27)/b5-4-,11-6-,14-9+,15-10+/t20-,21+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117249
PNG
((2S)-2,3-dihydroxypropyl (5Z,8Z,11Z,14Z)-icosa-5,8...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@@H](O)CO
Show InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-21-22(25)20-24/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-/t22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117244
PNG
(CHEMBL262560 | Icosa-5,8,11,14-tetraenoic acid 2,3...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@H](O)CO
Show InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-21-22(25)20-24/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-/t22-/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117248
PNG
(5-Hydroxy-icosa-6,8,11,14-tetraenoic acid (2-hydro...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C=C/[C@H](O)CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-21(25)17-15-18-22(26)23-19-20-24/h6-7,9-10,12-14,16,21,24-25H,2-5,8,11,15,17-20H2,1H3,(H,23,26)/b7-6-,10-9-,13-12-,16-14+/t21-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117252
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid (2-hydr...)
Show SMILES CCCCC[C@@H](O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-22(26)23-19-20-24/h4-5,8-11,14,17,21,24-25H,2-3,6-7,12-13,15-16,18-20H2,1H3,(H,23,26)/b5-4-,10-8-,11-9-,17-14+/t21-/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117253
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid 2,3-dih...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@H](O)CO
Show InChI InChI=1S/C23H38O5/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-23(27)28-20-22(26)19-24/h4-5,8-11,14,17,21-22,24-26H,2-3,6-7,12-13,15-16,18-20H2,1H3/b5-4-,10-8-,11-9-,17-14+/t21-,22+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117246
PNG
(5,15-Dihydroxy-icosa-6,8,11,13-tetraenoic acid (2-...)
Show SMILES CCCCC[C@@H](O)\C=C\C=C/C\C=C/C=C/[C@H](O)CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO4/c1-2-3-9-13-20(25)14-10-7-5-4-6-8-11-15-21(26)16-12-17-22(27)23-18-19-24/h5-8,10-11,14-15,20-21,24-26H,2-4,9,12-13,16-19H2,1H3,(H,23,27)/b7-5-,8-6-,14-10+,15-11+/t20-,21+/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117253
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid 2,3-dih...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@H](O)CO
Show InChI InChI=1S/C23H38O5/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-23(27)28-20-22(26)19-24/h4-5,8-11,14,17,21-22,24-26H,2-3,6-7,12-13,15-16,18-20H2,1H3/b5-4-,10-8-,11-9-,17-14+/t21-,22+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117254
PNG
(11-Hydroxy-icosa-5,8,12,14-tetraenoic acid (2-hydr...)
Show SMILES CCCCC\C=C/C=C/C(O)C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-7-10-13-16-21(25)17-14-11-8-6-9-12-15-18-22(26)23-19-20-24/h6-7,9-11,13-14,16,21,24-25H,2-5,8,12,15,17-20H2,1H3,(H,23,26)/b9-6-,10-7-,14-11-,16-13+
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117244
PNG
(CHEMBL262560 | Icosa-5,8,11,14-tetraenoic acid 2,3...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@H](O)CO
Show InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-21-22(25)20-24/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-/t22-/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117243
PNG
(8,15-Dihydroxy-icosa-5,9,11,13-tetraenoic acid (2-...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/C=C/[C@@H](O)C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO4/c1-2-3-8-13-20(25)14-9-4-5-10-15-21(26)16-11-6-7-12-17-22(27)23-18-19-24/h4-6,9-11,14-15,20-21,24-26H,2-3,7-8,12-13,16-19H2,1H3,(H,23,27)/b5-4-,11-6-,14-9+,15-10+/t20-,21+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117249
PNG
((2S)-2,3-dihydroxypropyl (5Z,8Z,11Z,14Z)-icosa-5,8...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@@H](O)CO
Show InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-21-22(25)20-24/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-/t22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117254
PNG
(11-Hydroxy-icosa-5,8,12,14-tetraenoic acid (2-hydr...)
Show SMILES CCCCC\C=C/C=C/C(O)C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-7-10-13-16-21(25)17-14-11-8-6-9-12-15-18-22(26)23-19-20-24/h6-7,9-11,13-14,16,21,24-25H,2-5,8,12,15,17-20H2,1H3,(H,23,26)/b9-6-,10-7-,14-11-,16-13+
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117250
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid (2-hydr...)
Show SMILES CCCCCC(O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-22(26)23-19-20-24/h4-5,8-11,14,17,21,24-25H,2-3,6-7,12-13,15-16,18-20H2,1H3,(H,23,26)/b5-4-,10-8-,11-9-,17-14+
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50117256
PNG
(15-Hydroxy-icosa-5,8,11,13-tetraenoic acid 2,3-dih...)
Show SMILES CCCCC[C@H](O)\C=C\C=C/C\C=C/C\C=C/CCCC(=O)OC[C@@H](O)CO
Show InChI InChI=1S/C23H38O5/c1-2-3-13-16-21(25)17-14-11-9-7-5-4-6-8-10-12-15-18-23(27)28-20-22(26)19-24/h4-5,8-11,14,17,21-22,24-26H,2-3,6-7,12-13,15-16,18-20H2,1H3/b5-4-,10-8-,11-9-,17-14+/t21-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117247
PNG
(11-Hydroxy-icosa-5,8,12,14-tetraenoic acid (2-hydr...)
Show SMILES CCCCC\C=C/C=C/[C@@H](O)C\C=C/C\C=C/CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO3/c1-2-3-4-5-7-10-13-16-21(25)17-14-11-8-6-9-12-15-18-22(26)23-19-20-24/h6-7,9-11,13-14,16,21,24-25H,2-5,8,12,15,17-20H2,1H3,(H,23,26)/b9-6-,10-7-,14-11-,16-13+/t21-/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50117246
PNG
(5,15-Dihydroxy-icosa-6,8,11,13-tetraenoic acid (2-...)
Show SMILES CCCCC[C@@H](O)\C=C\C=C/C\C=C/C=C/[C@H](O)CCCC(=O)NCCO
Show InChI InChI=1S/C22H37NO4/c1-2-3-9-13-20(25)14-10-7-5-4-6-8-11-15-21(26)16-12-17-22(27)23-18-19-24/h5-8,10-11,14-15,20-21,24-26H,2-4,9,12-13,16-19H2,1H3,(H,23,27)/b7-5-,8-6-,14-10+,15-11+/t20-,21+/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Utrecht University

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF


J Med Chem 45: 3709-20 (2002)


Article DOI: 10.1021/jm020818q
BindingDB Entry DOI: 10.7270/Q2WD3ZXN
More data for this
Ligand-Target Pair
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