BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 113 hits with Last Name = 'lemaire' and Initial = 'l'   
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
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50072775
PNG
(2-((1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohe...)
Show SMILES CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCO)c(O)c1 |r|
Show InChI InChI=1S/C24H40O3/c1-4-5-6-7-14-24(2,3)19-11-13-21(23(27)16-19)22-17-20(26)12-10-18(22)9-8-15-25/h11,13,16,18,20,22,25-27H,4-10,12,14-15,17H2,1-3H3/t18-,20-,22-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
1.30n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM21281
PNG
((11R)-2-methyl-11-(morpholin-4-ylmethyl)-3-(naphth...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@@H](CN4CCOCC4)n1c23 |r|
Show InChI InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448270
PNG
(CHEMBL2414029)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC1CC(C2)C3 |TLB:23:22:27:24.25,THB:23:24:27:21.22.28,25:26:21:23.24,25:24:21:26.27.28|
Show InChI InChI=1S/C24H30N2O3/c1-2-3-6-9-28-21-8-5-4-7-19(21)22-13-20(26-29-22)23(27)25-24-14-16-10-17(15-24)12-18(24)11-16/h4-5,7-8,13,16-18H,2-3,6,9-12,14-15H2,1H3,(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM21281
PNG
((11R)-2-methyl-11-(morpholin-4-ylmethyl)-3-(naphth...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@@H](CN4CCOCC4)n1c23 |r|
Show InChI InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
9.10n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50072775
PNG
(2-((1R,2R,5R)-5-hydroxy-2-(3-hydroxypropyl)cyclohe...)
Show SMILES CCCCCCC(C)(C)c1ccc([C@@H]2C[C@H](O)CC[C@H]2CCCO)c(O)c1 |r|
Show InChI InChI=1S/C24H40O3/c1-4-5-6-7-14-24(2,3)19-11-13-21(23(27)16-19)22-17-20(26)12-10-18(22)9-8-15-25/h11,13,16,18,20,22,25-27H,4-10,12,14-15,17H2,1-3H3/t18-,20-,22-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
15n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM21281
PNG
((11R)-2-methyl-11-(morpholin-4-ylmethyl)-3-(naphth...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@@H](CN4CCOCC4)n1c23 |r|
Show InChI InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
16n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50492861
PNG
(CHEMBL2414041)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)N(CC(C)C)CC(C)C
Show InChI InChI=1S/C23H34N2O3/c1-6-7-10-13-27-21-12-9-8-11-19(21)22-14-20(24-28-22)23(26)25(15-17(2)3)16-18(4)5/h8-9,11-12,14,17-18H,6-7,10,13,15-16H2,1-5H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
22n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292278
PNG
(CHEMBL4174271)
Show SMILES CCN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C18H20ClN5O/c1-3-23-8-10-24(11-9-23)16-15-18(21-12(2)20-16)25-17(22-15)13-6-4-5-7-14(13)19/h4-7H,3,8-11H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
23n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448267
PNG
(CHEMBL2414033)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C21H28N2O3/c1-2-3-9-14-25-19-13-8-7-12-17(19)20-15-18(23-26-20)21(24)22-16-10-5-4-6-11-16/h7-8,12-13,15-16H,2-6,9-11,14H2,1H3,(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
23n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292270
PNG
(CHEMBL4163588)
Show SMILES CN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C17H18ClN5O/c1-11-19-15(23-9-7-22(2)8-10-23)14-17(20-11)24-16(21-14)12-5-3-4-6-13(12)18/h3-6H,7-10H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
28n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448272
PNG
(CHEMBL2414023)
Show SMILES CCCCCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:26:25:22:28.27.29,26:27:24.25.30:22,29:27:24:30.21.22,29:21:24:28.26.27|
Show InChI InChI=1S/C26H34N2O3/c1-2-3-4-7-10-30-23-9-6-5-8-21(23)24-14-22(28-31-24)25(29)27-26-15-18-11-19(16-26)13-20(12-18)17-26/h5-6,8-9,14,18-20H,2-4,7,10-13,15-17H2,1H3,(H,27,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
31n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50492861
PNG
(CHEMBL2414041)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)N(CC(C)C)CC(C)C
Show InChI InChI=1S/C23H34N2O3/c1-6-7-10-13-27-21-12-9-8-11-19(21)22-14-20(24-28-22)23(26)25(15-17(2)3)16-18(4)5/h8-9,11-12,14,17-18H,6-7,10,13,15-16H2,1-5H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
33n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448273
PNG
(CHEMBL2414022)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:25:24:21:27.26.28,25:26:23.24.29:21,28:26:23:29.20.21,28:20:23:27.25.26|
Show InChI InChI=1S/C25H32N2O3/c1-2-3-6-9-29-22-8-5-4-7-20(22)23-13-21(27-30-23)24(28)26-25-14-17-10-18(15-25)12-19(11-17)16-25/h4-5,7-8,13,17-19H,2-3,6,9-12,14-16H2,1H3,(H,26,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
36n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50387881
PNG
(CHEMBL2057799)
Show SMILES CCN1CCN(CC1)c1nc(C)nc2nc([nH]c12)-c1ccccc1Cl
Show InChI InChI=1S/C18H21ClN6/c1-3-24-8-10-25(11-9-24)18-15-17(20-12(2)21-18)23-16(22-15)13-6-4-5-7-14(13)19/h4-7H,3,8-11H2,1-2H3,(H,20,21,22,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
51n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448271
PNG
(CHEMBL2414028)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:19:20:22:26.24.25,THB:24:23:20:26.25.27,24:25:22.23.29:20,27:25:22:29.28.20,27:28:22:26.24.25,(14.78,-14.02,;15.56,-12.7,;14.81,-11.36,;15.59,-10.04,;14.84,-8.7,;15.62,-7.38,;14.86,-6.04,;13.32,-6.03,;12.57,-4.67,;13.35,-3.35,;14.9,-3.37,;15.64,-4.72,;17.19,-4.74,;17.68,-3.28,;19.27,-3.33,;19.69,-4.77,;18.44,-5.67,;20.03,-1.98,;19.25,-.65,;21.58,-1.97,;22.84,-2.86,;22.85,-4.35,;21.65,-5.62,;23.15,-5.21,;24.57,-5.78,;25.57,-4.49,;24.17,-4.84,;25.59,-2.96,;24.18,-2.38,;23.14,-3.62,)|
Show InChI InChI=1S/C25H32N2O3/c1-2-3-6-9-29-22-8-5-4-7-20(22)23-15-21(27-30-23)25(28)26-24-18-11-16-10-17(13-18)14-19(24)12-16/h4-5,7-8,15-19,24H,2-3,6,9-14H2,1H3,(H,26,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
60n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448278
PNG
(CHEMBL2414035)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1CCCCCC1
Show InChI InChI=1S/C22H30N2O3/c1-2-3-10-15-26-20-14-9-8-13-18(20)21-16-19(24-27-21)22(25)23-17-11-6-4-5-7-12-17/h8-9,13-14,16-17H,2-7,10-12,15H2,1H3,(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
61n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448268
PNG
(CHEMBL2414032)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1CCCC1
Show InChI InChI=1S/C20H26N2O3/c1-2-3-8-13-24-18-12-7-6-11-16(18)19-14-17(22-25-19)20(23)21-15-9-4-5-10-15/h6-7,11-12,14-15H,2-5,8-10,13H2,1H3,(H,21,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
61n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448281
PNG
(CHEMBL2414018)
Show SMILES COc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:21:20:17:23.22.24,21:22:19.20.25:17,24:22:19:25.16.17,24:16:19:23.21.22|
Show InChI InChI=1S/C21H24N2O3/c1-25-18-5-3-2-4-16(18)19-9-17(23-26-19)20(24)22-21-10-13-6-14(11-21)8-15(7-13)12-21/h2-5,9,13-15H,6-8,10-12H2,1H3,(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
70n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448280
PNG
(CHEMBL2414036)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1CCCCCCC1
Show InChI InChI=1S/C23H32N2O3/c1-2-3-11-16-27-21-15-10-9-14-19(21)22-17-20(25-28-22)23(26)24-18-12-7-5-4-6-8-13-18/h9-10,14-15,17-18H,2-8,11-13,16H2,1H3,(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
74n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448275
PNG
(CHEMBL2414020)
Show SMILES CCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:23:22:19:25.24.26,23:24:21.22.27:19,26:24:21:27.18.19,26:18:21:25.23.24|
Show InChI InChI=1S/C23H28N2O3/c1-2-7-27-20-6-4-3-5-18(20)21-11-19(25-28-21)22(26)24-23-12-15-8-16(13-23)10-17(9-15)14-23/h3-6,11,15-17H,2,7-10,12-14H2,1H3,(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
80n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50160434
PNG
((6-iodo-2-methyl-1-(2-morpholinoethyl)-1H-indol-3-...)
Show SMILES COc1ccc(cc1)C(=O)c1c(C)n(CCN2CCOCC2)c2cc(I)ccc12
Show InChI InChI=1S/C23H25IN2O3/c1-16-22(23(27)17-3-6-19(28-2)7-4-17)20-8-5-18(24)15-21(20)26(16)10-9-25-11-13-29-14-12-25/h3-8,15H,9-14H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
91n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292266
PNG
(CHEMBL4169388)
Show SMILES CCN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C18H18F3N5O/c1-2-25-7-9-26(10-8-25)15-14-17(23-11-22-15)27-16(24-14)12-5-3-4-6-13(12)18(19,20)21/h3-6,11H,2,7-10H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
96n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292265
PNG
(CHEMBL4177237)
Show SMILES CN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C17H16F3N5O/c1-24-6-8-25(9-7-24)14-13-16(22-10-21-14)26-15(23-13)11-4-2-3-5-12(11)17(18,19)20/h2-5,10H,6-9H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
155n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Inhibition of I-VCAM-Ig binding to Very late antigen 4 (VLA-4)


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292267
PNG
(CHEMBL4162105)
Show SMILES CC(=O)N1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C18H16F3N5O2/c1-11(27)25-6-8-26(9-7-25)15-14-17(23-10-22-15)28-16(24-14)12-4-2-3-5-13(12)18(19,20)21/h2-5,10H,6-9H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
254n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292278
PNG
(CHEMBL4174271)
Show SMILES CCN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C18H20ClN5O/c1-3-23-8-10-24(11-9-23)16-15-18(21-12(2)20-16)25-17(22-15)13-6-4-5-7-14(13)19/h4-7H,3,8-11H2,1-2H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
293n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Inhibition of rate of ADP-stimulated gel-filtered human platelet aggregation mediated by integrin alphaIIb beta-3 in PLAGGIN assay


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292279
PNG
(CHEMBL4176159)
Show SMILES CCN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C17H18ClN5O/c1-2-22-7-9-23(10-8-22)15-14-17(20-11-19-15)24-16(21-14)12-5-3-4-6-13(12)18/h3-6,11H,2,7-10H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
329n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292269
PNG
(CHEMBL4165549)
Show SMILES CN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C16H16ClN5O/c1-21-6-8-22(9-7-21)14-13-16(19-10-18-14)23-15(20-13)11-4-2-3-5-12(11)17/h2-5,10H,6-9H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
350n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448274
PNG
(CHEMBL2414021)
Show SMILES CCCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:24:23:20:26.25.27,24:25:22.23.28:20,27:25:22:28.19.20,27:19:22:26.24.25|
Show InChI InChI=1S/C24H30N2O3/c1-2-3-8-28-21-7-5-4-6-19(21)22-12-20(26-29-22)23(27)25-24-13-16-9-17(14-24)11-18(10-16)15-24/h4-7,12,16-18H,2-3,8-11,13-15H2,1H3,(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
369n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448269
PNG
(CHEMBL2414031)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1CCC1
Show InChI InChI=1S/C19H24N2O3/c1-2-3-6-12-23-17-11-5-4-10-15(17)18-13-16(21-24-18)19(22)20-14-8-7-9-14/h4-5,10-11,13-14H,2-3,6-9,12H2,1H3,(H,20,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
412n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50492868
PNG
(CHEMBL2414034)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NN1CCCCC1
Show InChI InChI=1S/C20H27N3O3/c1-2-3-9-14-25-18-11-6-5-10-16(18)19-15-17(22-26-19)20(24)21-23-12-7-4-8-13-23/h5-6,10-11,15H,2-4,7-9,12-14H2,1H3,(H,21,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
600n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50292280
PNG
(CHEMBL4168970)
Show SMILES CC(=O)N1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C17H16ClN5O2/c1-11(24)22-6-8-23(9-7-22)15-14-17(20-10-19-15)25-16(21-14)12-4-2-3-5-13(12)18/h2-5,10H,6-9H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
678n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448269
PNG
(CHEMBL2414031)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1CCC1
Show InChI InChI=1S/C19H24N2O3/c1-2-3-6-12-23-17-11-5-4-10-15(17)18-13-16(21-24-18)19(22)20-14-8-7-9-14/h4-5,10-11,13-14H,2-3,6-9,12H2,1H3,(H,20,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50492866
PNG
(CHEMBL2414024)
Show SMILES CCCCCCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:27:26:23:29.28.30,27:28:25.26.31:23,30:28:25:31.22.23,30:22:25:29.27.28|
Show InChI InChI=1S/C27H36N2O3/c1-2-3-4-5-8-11-31-24-10-7-6-9-22(24)25-15-23(29-32-25)26(30)28-27-16-19-12-20(17-27)14-21(13-19)18-27/h6-7,9-10,15,19-21H,2-5,8,11-14,16-18H2,1H3,(H,28,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448276
PNG
(CHEMBL2414019)
Show SMILES CCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:22:21:18:24.23.25,22:23:20.21.26:18,25:23:20:26.17.18,25:17:20:24.22.23|
Show InChI InChI=1S/C22H26N2O3/c1-2-26-19-6-4-3-5-17(19)20-10-18(24-27-20)21(25)23-22-11-14-7-15(12-22)9-16(8-14)13-22/h3-6,10,14-16H,2,7-9,11-13H2,1H3,(H,23,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448275
PNG
(CHEMBL2414020)
Show SMILES CCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:23:22:19:25.24.26,23:24:21.22.27:19,26:24:21:27.18.19,26:18:21:25.23.24|
Show InChI InChI=1S/C23H28N2O3/c1-2-7-27-20-6-4-3-5-18(20)21-11-19(25-28-21)22(26)24-23-12-15-8-16(13-23)10-17(9-15)14-23/h3-6,11,15-17H,2,7-10,12-14H2,1H3,(H,24,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448277
PNG
(CHEMBL2414017)
Show SMILES O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc(on1)-c1ccccc1 |THB:9:8:5:11.10.12,9:10:7.8.13:5,12:10:7:13.4.5,12:4:7:11.9.10|
Show InChI InChI=1S/C21H24N2O2/c24-20(18-9-19(25-23-18)17-4-2-1-3-5-17)22-13-21-10-14-6-15(11-21)8-16(7-14)12-21/h1-5,9,14-16H,6-8,10-13H2,(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448270
PNG
(CHEMBL2414029)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC12CC3CC1CC(C2)C3 |TLB:23:22:27:24.25,THB:23:24:27:21.22.28,25:26:21:23.24,25:24:21:26.27.28|
Show InChI InChI=1S/C24H30N2O3/c1-2-3-6-9-28-21-8-5-4-7-19(21)22-13-20(26-29-22)23(27)25-24-14-16-10-17(15-24)12-18(24)11-16/h4-5,7-8,13,16-18H,2-3,6,9-12,14-15H2,1H3,(H,25,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-SR141716A from human CB1 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50492867
PNG
(CHEMBL2414037)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C21H22N2O3/c1-2-3-9-14-25-19-13-8-7-12-17(19)20-15-18(23-26-20)21(24)22-16-10-5-4-6-11-16/h4-8,10-13,15H,2-3,9,14H2,1H3,(H,22,24)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448284
PNG
(CHEMBL2414027)
Show SMILES CCCCCOc1ccc(cc1)-c1cc(no1)C(=O)NC12CC3CC(CC(C3)C1)C2 |THB:25:24:21:27.26.28,25:26:23.24.29:21,28:26:23:29.20.21,28:20:23:27.25.26|
Show InChI InChI=1S/C25H32N2O3/c1-2-3-4-9-29-21-7-5-20(6-8-21)23-13-22(27-30-23)24(28)26-25-14-17-10-18(15-25)12-19(11-17)16-25/h5-8,13,17-19H,2-4,9-12,14-16H2,1H3,(H,26,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50448282
PNG
(CHEMBL2414015)
Show SMILES O=C(NC12CC3CC(CC(C3)C1)C2)c1cc(on1)-c1ccccc1 |THB:8:7:4:10.9.11,8:9:6.7.12:4,11:9:6:12.3.4,11:3:6:10.8.9|
Show InChI InChI=1S/C20H22N2O2/c23-19(17-9-18(24-22-17)16-4-2-1-3-5-16)21-20-10-13-6-14(11-20)8-15(7-13)12-20/h1-5,9,13-15H,6-8,10-12H2,(H,21,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50492869
PNG
(CHEMBL2414030)
Show SMILES CCCCCOc1ccccc1-c1cc(no1)C(=O)NC1CC1
Show InChI InChI=1S/C18H22N2O3/c1-2-3-6-11-22-16-8-5-4-7-14(16)17-12-15(20-23-17)18(21)19-13-9-10-13/h4-5,7-8,12-13H,2-3,6,9-11H2,1H3,(H,19,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor expressed in CHO membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 21: 5383-94 (2013)


Article DOI: 10.1016/j.bmc.2013.06.010
BindingDB Entry DOI: 10.7270/Q27S7RQW
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292256
PNG
(CHEMBL4167826)
Show SMILES CCCCNc1ncnc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C15H15ClN4O/c1-2-3-8-17-13-12-15(19-9-18-13)21-14(20-12)10-6-4-5-7-11(10)16/h4-7,9H,2-3,8H2,1H3,(H,17,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292257
PNG
(CHEMBL4175043)
Show SMILES COCCNc1ncnc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C14H13ClN4O2/c1-20-7-6-16-12-11-14(18-8-17-12)21-13(19-11)9-4-2-3-5-10(9)15/h2-5,8H,6-7H2,1H3,(H,16,17,18)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Inhibition of Alpha4-beta1 integrin in Jurkat cells


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292258
PNG
(CHEMBL4164392)
Show SMILES CCCCCNc1ncnc2oc(nc12)-c1ccccc1Cl
Show InChI InChI=1S/C16H17ClN4O/c1-2-3-6-9-18-14-13-16(20-10-19-14)22-15(21-13)11-7-4-5-8-12(11)17/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,18,19,20)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292259
PNG
(CHEMBL4166726)
Show SMILES Clc1ccccc1-c1nc2c(NCC3CCCCC3)ncnc2o1
Show InChI InChI=1S/C18H19ClN4O/c19-14-9-5-4-8-13(14)17-23-15-16(21-11-22-18(15)24-17)20-10-12-6-2-1-3-7-12/h4-5,8-9,11-12H,1-3,6-7,10H2,(H,20,21,22)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292260
PNG
(CHEMBL4174629)
Show SMILES Clc1ccccc1-c1nc2c(NCC3CCNCC3)ncnc2o1
Show InChI InChI=1S/C17H18ClN5O/c18-13-4-2-1-3-12(13)16-23-14-15(21-10-22-17(14)24-16)20-9-11-5-7-19-8-6-11/h1-4,10-11,19H,5-9H2,(H,20,21,22)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292261
PNG
(CHEMBL4163287)
Show SMILES CN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1
Show InChI InChI=1S/C16H17N5O/c1-20-7-9-21(10-8-20)14-13-16(18-11-17-14)22-15(19-13)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292262
PNG
(CHEMBL4171188)
Show SMILES CCN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1
Show InChI InChI=1S/C17H19N5O/c1-2-21-8-10-22(11-9-21)15-14-17(19-12-18-15)23-16(20-14)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292263
PNG
(CHEMBL4164823)
Show SMILES CN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1F
Show InChI InChI=1S/C16H16FN5O/c1-21-6-8-22(9-7-21)14-13-16(19-10-18-14)23-15(20-13)11-4-2-3-5-12(11)17/h2-5,10H,6-9H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50292264
PNG
(CHEMBL4172723)
Show SMILES CCN1CCN(CC1)c1ncnc2oc(nc12)-c1ccccc1F
Show InChI InChI=1S/C17H18FN5O/c1-2-22-7-9-23(10-8-22)15-14-17(20-11-19-15)24-16(21-14)12-5-3-4-6-13(12)18/h3-6,11H,2,7-10H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Univ. Lille

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 expressed in CHO cells after 90 mins by TopCount scintillation counting method


Eur J Med Chem 146: 68-78 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.034
BindingDB Entry DOI: 10.7270/Q2N58PXN
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 113 total )  |  Next  |  Last  >>
Jump to: