Found 27 hits Enz. Inhib. hit(s) with all data for entry = 50042828 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM21281
((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
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| 3.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM21278
(5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl...)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1 Show InChI InChI=1S/C22H21Cl3N4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| 7.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM21281
((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
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| 46 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431807
(CHEMBL2347041)Show SMILES CCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C20H19Cl3N2/c1-2-3-4-5-17-13-20(14-6-8-15(21)9-7-14)25(24-17)19-11-10-16(22)12-18(19)23/h6-13H,2-5H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 458 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50147009
(5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-3-hexy...)Show SMILES CCCCCCc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C20H20Cl3N3/c1-2-3-4-5-6-19-24-20(14-7-9-15(21)10-8-14)26(25-19)18-12-11-16(22)13-17(18)23/h7-13H,2-6H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| 829 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431808
(CHEMBL2347040)Show InChI InChI=1S/C20H22N2/c1-2-3-6-13-18-16-20(17-11-7-4-8-12-17)22(21-18)19-14-9-5-10-15-19/h4-5,7-12,14-16H,2-3,6,13H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.94E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50147009
(5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-3-hexy...)Show SMILES CCCCCCc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C20H20Cl3N3/c1-2-3-4-5-6-19-24-20(14-7-9-15(21)10-8-14)26(25-19)18-12-11-16(22)13-17(18)23/h7-13H,2-6H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| 3.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431803
(CHEMBL2347045)Show SMILES O=C(NN1CCCCC1)c1cc(-c2ccccc2)n(n1)-c1ccccc1 Show InChI InChI=1S/C21H22N4O/c26-21(23-24-14-8-3-9-15-24)19-16-20(17-10-4-1-5-11-17)25(22-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,23,26) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431808
(CHEMBL2347040)Show InChI InChI=1S/C20H22N2/c1-2-3-6-13-18-16-20(17-11-7-4-8-12-17)22(21-18)19-14-9-5-10-15-19/h4-5,7-12,14-16H,2-3,6,13H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 6.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431800
(CHEMBL2347048)Show SMILES Cc1c(nn(c1-c1ccccc1)-c1ccccc1)C(=O)NN1CCCCC1 Show InChI InChI=1S/C22H24N4O/c1-17-20(22(27)24-25-15-9-4-10-16-25)23-26(19-13-7-3-8-14-19)21(17)18-11-5-2-6-12-18/h2-3,5-8,11-14H,4,9-10,15-16H2,1H3,(H,24,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431804
(CHEMBL2347044)Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1 Show InChI InChI=1S/C32H45N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-26-33-32(36)30-27-31(28-22-17-15-18-23-28)35(34-30)29-24-19-16-20-25-29/h15-20,22-25,27H,2-14,21,26H2,1H3,(H,33,36) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431801
(CHEMBL2347047)Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C33H47N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-34-33(37)31-28(2)32(29-23-18-16-19-24-29)36(35-31)30-25-20-17-21-26-30/h16-21,23-26H,3-15,22,27H2,1-2H3,(H,34,37) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431798
(CHEMBL2347050)Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C31H42Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-34-31(38)29-35-30(25-16-18-26(32)19-17-25)37(36-29)28-22-20-27(33)21-23-28/h16-23H,2-15,24H2,1H3,(H,34,38) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431798
(CHEMBL2347050)Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C31H42Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-34-31(38)29-35-30(25-16-18-26(32)19-17-25)37(36-29)28-22-20-27(33)21-23-28/h16-23H,2-15,24H2,1H3,(H,34,38) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431801
(CHEMBL2347047)Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C33H47N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-34-33(37)31-28(2)32(29-23-18-16-19-24-29)36(35-31)30-25-20-17-21-26-30/h16-21,23-26H,3-15,22,27H2,1-2H3,(H,34,37) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431800
(CHEMBL2347048)Show SMILES Cc1c(nn(c1-c1ccccc1)-c1ccccc1)C(=O)NN1CCCCC1 Show InChI InChI=1S/C22H24N4O/c1-17-20(22(27)24-25-15-9-4-10-16-25)23-26(19-13-7-3-8-14-19)21(17)18-11-5-2-6-12-18/h2-3,5-8,11-14H,4,9-10,15-16H2,1H3,(H,24,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.82E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431803
(CHEMBL2347045)Show SMILES O=C(NN1CCCCC1)c1cc(-c2ccccc2)n(n1)-c1ccccc1 Show InChI InChI=1S/C21H22N4O/c26-21(23-24-14-8-3-9-15-24)19-16-20(17-10-4-1-5-11-17)25(22-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,23,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.79E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431802
(CHEMBL2347046)Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C35H49N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-29-36-35(39)33-30(2)34(31-25-20-18-21-26-31)38(37-33)32-27-22-19-23-28-32/h10-11,18-23,25-28H,3-9,12-17,24,29H2,1-2H3,(H,36,39)/b11-10- | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431804
(CHEMBL2347044)Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1 Show InChI InChI=1S/C32H45N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-26-33-32(36)30-27-31(28-22-17-15-18-23-28)35(34-30)29-24-19-16-20-25-29/h15-20,22-25,27H,2-14,21,26H2,1H3,(H,33,36) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431806
(CHEMBL2347042)Show SMILES CCCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C21H21Cl3N2/c1-2-3-4-5-6-18-14-21(15-7-9-16(22)10-8-15)26(25-18)20-12-11-17(23)13-19(20)24/h7-14H,2-6H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431806
(CHEMBL2347042)Show SMILES CCCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C21H21Cl3N2/c1-2-3-4-5-6-18-14-21(15-7-9-16(22)10-8-15)26(25-18)20-12-11-17(23)13-19(20)24/h7-14H,2-6H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431807
(CHEMBL2347041)Show SMILES CCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C20H19Cl3N2/c1-2-3-4-5-17-13-20(14-6-8-15(21)9-7-14)25(24-17)19-11-10-16(22)12-18(19)23/h6-13H,2-5H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431802
(CHEMBL2347046)Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C35H49N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-29-36-35(39)33-30(2)34(31-25-20-18-21-26-31)38(37-33)32-27-22-19-23-28-32/h10-11,18-23,25-28H,3-9,12-17,24,29H2,1-2H3,(H,36,39)/b11-10- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431799
(CHEMBL2347049)Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C33H44Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-36-33(40)31-37-32(27-18-20-28(34)21-19-27)39(38-31)30-24-22-29(35)23-25-30/h9-10,18-25H,2-8,11-17,26H2,1H3,(H,36,40)/b10-9- | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431799
(CHEMBL2347049)Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C33H44Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-36-33(40)31-37-32(27-18-20-28(34)21-19-27)39(38-31)30-24-22-29(35)23-25-30/h9-10,18-25H,2-8,11-17,26H2,1H3,(H,36,40)/b10-9- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50431805
(CHEMBL2347043)Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1 Show InChI InChI=1S/C34H47N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-28-35-34(38)32-29-33(30-24-19-17-20-25-30)37(36-32)31-26-21-18-22-27-31/h9-10,17-22,24-27,29H,2-8,11-16,23,28H2,1H3,(H,35,38)/b10-9- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50431805
(CHEMBL2347043)Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1 Show InChI InChI=1S/C34H47N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-28-35-34(38)32-29-33(30-24-19-17-20-25-30)37(36-32)31-26-21-18-22-27-31/h9-10,17-22,24-27,29H,2-8,11-16,23,28H2,1H3,(H,35,38)/b10-9- | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Instituto de Qu£mica M£dica
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis |
Bioorg Med Chem 21: 1708-16 (2013)
Article DOI: 10.1016/j.bmc.2013.01.055
BindingDB Entry DOI: 10.7270/Q2MG7QW1 |
More data for this
Ligand-Target Pair | |
Search and Browse
