Found 67 hits Enz. Inhib. hit(s) with all data for entry = 50002693 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 1
(Homo sapiens (Human)) | BDBM27337
(1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-...)Show SMILES CCNC1(CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)C(N)=O Show InChI InChI=1S/C25H25Cl2N7O/c1-2-31-25(24(28)35)11-13-33(14-12-25)22-20-23(30-15-29-22)34(17-9-7-16(26)8-10-17)21(32-20)18-5-3-4-6-19(18)27/h3-10,15,31H,2,11-14H2,1H3,(H2,28,35) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461710
(CHEMBL4225147)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2cccc(Cl)c2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C28H23Cl3N6/c29-20-8-10-22(11-9-20)37-26(23-6-1-2-7-24(23)31)34-25-27(32-18-33-28(25)37)36-14-12-35(13-15-36)17-19-4-3-5-21(30)16-19/h1-11,16,18H,12-15,17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461703
(CHEMBL4225421)Show SMILES Clc1ccc(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C28H23Cl3N6/c29-20-7-5-19(6-8-20)17-35-13-15-36(16-14-35)27-25-28(33-18-32-27)37(22-11-9-21(30)10-12-22)26(34-25)23-3-1-2-4-24(23)31/h1-12,18H,13-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461698
(CHEMBL4227354)Show SMILES CC(N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C29H26Cl2N6/c1-20(21-7-3-2-4-8-21)35-15-17-36(18-16-35)28-26-29(33-19-32-28)37(23-13-11-22(30)12-14-23)27(34-26)24-9-5-6-10-25(24)31/h2-14,19-20H,15-18H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461688
(CHEMBL4225049)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C1CCCCC1)-c1ccccc1Cl Show InChI InChI=1S/C27H28Cl2N6/c28-19-10-12-21(13-11-19)35-25(22-8-4-5-9-23(22)29)32-24-26(30-18-31-27(24)35)34-16-14-33(15-17-34)20-6-2-1-3-7-20/h4-5,8-13,18,20H,1-3,6-7,14-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461693
(CHEMBL4228096)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)c1ccccc1)-c1ccccc1Cl Show InChI InChI=1S/C27H22Cl2N6/c28-19-10-12-21(13-11-19)35-25(22-8-4-5-9-23(22)29)32-24-26(30-18-31-27(24)35)34-16-14-33(15-17-34)20-6-2-1-3-7-20/h1-13,18H,14-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461691
(CHEMBL4224946)Show SMILES Fc1ccc(cc1)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C27H21Cl2FN6/c28-18-5-9-21(10-6-18)36-25(22-3-1-2-4-23(22)29)33-24-26(31-17-32-27(24)36)35-15-13-34(14-16-35)20-11-7-19(30)8-12-20/h1-12,17H,13-16H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461685
(CHEMBL4227442)Show SMILES FC(F)(F)Oc1ccccc1CN1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C29H23Cl2F3N6O/c30-20-9-11-21(12-10-20)40-26(22-6-2-3-7-23(22)31)37-25-27(35-18-36-28(25)40)39-15-13-38(14-16-39)17-19-5-1-4-8-24(19)41-29(32,33)34/h1-12,18H,13-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461705
(CHEMBL4226777)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CCc2ccccc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C29H26Cl2N6/c30-22-10-12-23(13-11-22)37-27(24-8-4-5-9-25(24)31)34-26-28(32-20-33-29(26)37)36-18-16-35(17-19-36)15-14-21-6-2-1-3-7-21/h1-13,20H,14-19H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461694
(CHEMBL4225213)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)c1ccccc1C#N)-c1ccccc1Cl Show InChI InChI=1S/C28H21Cl2N7/c29-20-9-11-21(12-10-20)37-26(22-6-2-3-7-23(22)30)34-25-27(32-18-33-28(25)37)36-15-13-35(14-16-36)24-8-4-1-5-19(24)17-31/h1-12,18H,13-16H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461695
(CHEMBL4226066)Show SMILES COc1ccccc1N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C28H24Cl2N6O/c1-37-24-9-5-4-8-23(24)34-14-16-35(17-15-34)27-25-28(32-18-31-27)36(20-12-10-19(29)11-13-20)26(33-25)21-6-2-3-7-22(21)30/h2-13,18H,14-17H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461712
(CHEMBL4229172)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)c1ccccn1)-c1ccccc1Cl Show InChI InChI=1S/C26H21Cl2N7/c27-18-8-10-19(11-9-18)35-24(20-5-1-2-6-21(20)28)32-23-25(30-17-31-26(23)35)34-15-13-33(14-16-34)22-7-3-4-12-29-22/h1-12,17H,13-16H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461686
(CHEMBL4228748)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)c1ccc(cc1)C#N)-c1ccccc1Cl Show InChI InChI=1S/C28H21Cl2N7/c29-20-7-11-22(12-8-20)37-26(23-3-1-2-4-24(23)30)34-25-27(32-18-33-28(25)37)36-15-13-35(14-16-36)21-9-5-19(17-31)6-10-21/h1-12,18H,13-16H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM27343
(8-(2-chlorophenyl)-9-(4-chlorophenyl)-6-(4-methylp...)Show SMILES CN1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C22H20Cl2N6/c1-28-10-12-29(13-11-28)21-19-22(26-14-25-21)30(16-8-6-15(23)7-9-16)20(27-19)17-4-2-3-5-18(17)24/h2-9,14H,10-13H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461700
(CHEMBL4229032)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2ccncc2Cl)CC1)-c1ccccc1Cl Show InChI InChI=1S/C27H22Cl3N7/c28-19-5-7-20(8-6-19)37-25(21-3-1-2-4-22(21)29)34-24-26(32-17-33-27(24)37)36-13-11-35(12-14-36)16-18-9-10-31-15-23(18)30/h1-10,15,17H,11-14,16H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461696
(CHEMBL4225525)Show SMILES COc1ccc(cc1)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C28H24Cl2N6O/c1-37-22-12-10-20(11-13-22)34-14-16-35(17-15-34)27-25-28(32-18-31-27)36(21-8-6-19(29)7-9-21)26(33-25)23-4-2-3-5-24(23)30/h2-13,18H,14-17H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461687
(CHEMBL4226710)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2ccccc2C#N)CC1)-c1ccccc1Cl Show InChI InChI=1S/C29H23Cl2N7/c30-22-9-11-23(12-10-22)38-27(24-7-3-4-8-25(24)31)35-26-28(33-19-34-29(26)38)37-15-13-36(14-16-37)18-21-6-2-1-5-20(21)17-32/h1-12,19H,13-16,18H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461697
(CHEMBL4225260)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2ccccc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C28H24Cl2N6/c29-21-10-12-22(13-11-21)36-26(23-8-4-5-9-24(23)30)33-25-27(31-19-32-28(25)36)35-16-14-34(15-17-35)18-20-6-2-1-3-7-20/h1-13,19H,14-18H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461702
(CHEMBL4225999)Show SMILES Fc1ccc(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C28H23Cl2FN6/c29-20-7-11-22(12-8-20)37-26(23-3-1-2-4-24(23)30)34-25-27(32-18-33-28(25)37)36-15-13-35(14-16-36)17-19-5-9-21(31)10-6-19/h1-12,18H,13-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461692
(CHEMBL4227013)Show SMILES Cc1ccccc1CN1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C29H26Cl2N6/c1-20-6-2-3-7-21(20)18-35-14-16-36(17-15-35)28-26-29(33-19-32-28)37(23-12-10-22(30)11-13-23)27(34-26)24-8-4-5-9-25(24)31/h2-13,19H,14-18H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461701
(CHEMBL4225928)Show SMILES FC(F)(F)c1ccccc1CN1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C29H23Cl2F3N6/c30-20-9-11-21(12-10-20)40-26(22-6-2-4-8-24(22)31)37-25-27(35-18-36-28(25)40)39-15-13-38(14-16-39)17-19-5-1-3-7-23(19)29(32,33)34/h1-12,18H,13-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461708
(CHEMBL4225409)Show SMILES Fc1ccccc1CN1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C28H23Cl2FN6/c29-20-9-11-21(12-10-20)37-26(22-6-2-3-7-23(22)30)34-25-27(32-18-33-28(25)37)36-15-13-35(14-16-36)17-19-5-1-4-8-24(19)31/h1-12,18H,13-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461707
(CHEMBL4225446)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(C#N)c1ccccc1)-c1ccccc1Cl Show InChI InChI=1S/C29H23Cl2N7/c30-21-10-12-22(13-11-21)38-27(23-8-4-5-9-24(23)31)35-26-28(33-19-34-29(26)38)37-16-14-36(15-17-37)25(18-32)20-6-2-1-3-7-20/h1-13,19,25H,14-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461709
(CHEMBL4225349)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2ccccc2Cl)CC1)-c1ccccc1Cl Show InChI InChI=1S/C28H23Cl3N6/c29-20-9-11-21(12-10-20)37-26(22-6-2-4-8-24(22)31)34-25-27(32-18-33-28(25)37)36-15-13-35(14-16-36)17-19-5-1-3-7-23(19)30/h1-12,18H,13-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461714
(CHEMBL4225343)Show SMILES Cc1c(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cnn1C Show InChI InChI=1S/C27H26Cl2N8/c1-18-19(15-32-34(18)2)16-35-11-13-36(14-12-35)26-24-27(31-17-30-26)37(21-9-7-20(28)8-10-21)25(33-24)22-5-3-4-6-23(22)29/h3-10,15,17H,11-14,16H2,1-2H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461711
(CHEMBL4227115)Show SMILES Cc1ccc(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C29H26Cl2N6/c1-20-6-8-21(9-7-20)18-35-14-16-36(17-15-35)28-26-29(33-19-32-28)37(23-12-10-22(30)11-13-23)27(34-26)24-4-2-3-5-25(24)31/h2-13,19H,14-18H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461713
(CHEMBL4229050)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CCc2ccncc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C28H25Cl2N7/c29-21-5-7-22(8-6-21)37-26(23-3-1-2-4-24(23)30)34-25-27(32-19-33-28(25)37)36-17-15-35(16-18-36)14-11-20-9-12-31-13-10-20/h1-10,12-13,19H,11,14-18H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461689
(CHEMBL4229155)Show SMILES CC(N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)c1ccncc1 Show InChI InChI=1S/C28H25Cl2N7/c1-19(20-10-12-31-13-11-20)35-14-16-36(17-15-35)27-25-28(33-18-32-27)37(22-8-6-21(29)7-9-22)26(34-25)23-4-2-3-5-24(23)30/h2-13,18-19H,14-17H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461690
(CHEMBL4225671)Show SMILES COc1ccc(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C29H26Cl2N6O/c1-38-23-12-6-20(7-13-23)18-35-14-16-36(17-15-35)28-26-29(33-19-32-28)37(22-10-8-21(30)9-11-22)27(34-26)24-4-2-3-5-25(24)31/h2-13,19H,14-18H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461699
(CHEMBL4225661)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2ccncc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C27H23Cl2N7/c28-20-5-7-21(8-6-20)36-25(22-3-1-2-4-23(22)29)33-24-26(31-18-32-27(24)36)35-15-13-34(14-16-35)17-19-9-11-30-12-10-19/h1-12,18H,13-17H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461704
(CHEMBL4227549)Show SMILES Cc1nc(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)no1 Show InChI InChI=1S/C25H22Cl2N8O/c1-16-30-21(32-36-16)14-33-10-12-34(13-11-33)24-22-25(29-15-28-24)35(18-8-6-17(26)7-9-18)23(31-22)19-4-2-3-5-20(19)27/h2-9,15H,10-14H2,1H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 24 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50461706
(CHEMBL4228756)Show SMILES Oc1cccc(c1)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C27H22Cl2N6O/c28-18-8-10-19(11-9-18)35-25(22-6-1-2-7-23(22)29)32-24-26(30-17-31-27(24)35)34-14-12-33(13-15-34)20-4-3-5-21(36)16-20/h1-11,16-17,36H,12-15H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461688
(CHEMBL4225049)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C1CCCCC1)-c1ccccc1Cl Show InChI InChI=1S/C27H28Cl2N6/c28-19-10-12-21(13-11-19)35-25(22-8-4-5-9-23(22)29)32-24-26(30-18-31-27(24)35)34-16-14-33(15-17-34)20-6-2-1-3-7-20/h4-5,8-13,18,20H,1-3,6-7,14-17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 110 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461697
(CHEMBL4225260)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2ccccc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C28H24Cl2N6/c29-21-10-12-22(13-11-21)36-26(23-8-4-5-9-24(23)30)33-25-27(31-19-32-28(25)36)35-16-14-34(15-17-35)18-20-6-2-1-3-7-20/h1-13,19H,14-18H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 430 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461707
(CHEMBL4225446)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)C(C#N)c1ccccc1)-c1ccccc1Cl Show InChI InChI=1S/C29H23Cl2N7/c30-21-10-12-22(13-11-21)38-27(23-8-4-5-9-24(23)31)35-26-28(33-19-34-29(26)38)37-16-14-36(15-17-37)25(18-32)20-6-2-1-3-7-20/h1-13,19,25H,14-17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 460 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461713
(CHEMBL4229050)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CCc2ccncc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C28H25Cl2N7/c29-21-5-7-22(8-6-21)37-26(23-3-1-2-4-24(23)30)34-25-27(32-19-33-28(25)37)36-17-15-35(16-18-36)14-11-20-9-12-31-13-10-20/h1-10,12-13,19H,11,14-18H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 630 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461714
(CHEMBL4225343)Show SMILES Cc1c(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cnn1C Show InChI InChI=1S/C27H26Cl2N8/c1-18-19(15-32-34(18)2)16-35-11-13-36(14-12-35)26-24-27(31-17-30-26)37(21-9-7-20(28)8-10-21)25(33-24)22-5-3-4-6-23(22)29/h3-10,15,17H,11-14,16H2,1-2H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 990 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461689
(CHEMBL4229155)Show SMILES CC(N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)c1ccncc1 Show InChI InChI=1S/C28H25Cl2N7/c1-19(20-10-12-31-13-11-20)35-14-16-36(17-15-35)27-25-28(33-18-32-27)37(22-8-6-21(29)7-9-22)26(34-25)23-4-2-3-5-24(23)30/h2-13,18-19H,14-17H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461698
(CHEMBL4227354)Show SMILES CC(N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)c1ccccc1 Show InChI InChI=1S/C29H26Cl2N6/c1-20(21-7-3-2-4-8-21)35-15-17-36(18-16-35)28-26-29(33-19-32-28)37(23-13-11-22(30)12-14-23)27(34-26)24-9-5-6-10-25(24)31/h2-14,19-20H,15-18H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461712
(CHEMBL4229172)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)c1ccccn1)-c1ccccc1Cl Show InChI InChI=1S/C26H21Cl2N7/c27-18-8-10-19(11-9-18)35-24(20-5-1-2-6-21(20)28)32-23-25(30-17-31-26(23)35)34-15-13-33(14-16-34)22-7-3-4-12-29-22/h1-12,17H,13-16H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461699
(CHEMBL4225661)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(Cc2ccncc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C27H23Cl2N7/c28-20-5-7-21(8-6-20)36-25(22-3-1-2-4-23(22)29)33-24-26(31-18-32-27(24)36)35-15-13-34(14-16-35)17-19-9-11-30-12-10-19/h1-12,18H,13-17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461705
(CHEMBL4226777)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CCc2ccccc2)CC1)-c1ccccc1Cl Show InChI InChI=1S/C29H26Cl2N6/c30-22-10-12-23(13-11-22)37-27(24-8-4-5-9-25(24)31)34-26-28(32-20-33-29(26)37)36-18-16-35(17-19-36)15-14-21-6-2-1-3-7-21/h1-13,20H,14-19H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461708
(CHEMBL4225409)Show SMILES Fc1ccccc1CN1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C28H23Cl2FN6/c29-20-9-11-21(12-10-20)37-26(22-6-2-3-7-23(22)30)34-25-27(32-18-33-28(25)37)36-15-13-35(14-16-36)17-19-5-1-4-8-24(19)31/h1-12,18H,13-17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461704
(CHEMBL4227549)Show SMILES Cc1nc(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)no1 Show InChI InChI=1S/C25H22Cl2N8O/c1-16-30-21(32-36-16)14-33-10-12-34(13-11-33)24-22-25(29-15-28-24)35(18-8-6-17(26)7-9-18)23(31-22)19-4-2-3-5-20(19)27/h2-9,15H,10-14H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 3.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461692
(CHEMBL4227013)Show SMILES Cc1ccccc1CN1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C29H26Cl2N6/c1-20-6-2-3-7-21(20)18-35-14-16-36(17-15-35)28-26-29(33-19-32-28)37(23-12-10-22(30)11-13-23)27(34-26)24-8-4-5-9-25(24)31/h2-13,19H,14-18H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 4.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461695
(CHEMBL4226066)Show SMILES COc1ccccc1N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C28H24Cl2N6O/c1-37-24-9-5-4-8-23(24)34-14-16-35(17-15-34)27-25-28(32-18-31-27)36(20-12-10-19(29)11-13-20)26(33-25)21-6-2-3-7-22(21)30/h2-13,18H,14-17H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461691
(CHEMBL4224946)Show SMILES Fc1ccc(cc1)N1CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1 Show InChI InChI=1S/C27H21Cl2FN6/c28-18-5-9-21(10-6-18)36-25(22-3-1-2-4-23(22)29)33-24-26(31-17-32-27(24)36)35-15-13-34(14-16-35)20-11-7-19(30)8-12-20/h1-12,17H,13-16H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 5.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM27337
(1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)-9H-purin-...)Show SMILES CCNC1(CCN(CC1)c1ncnc2n(c(nc12)-c1ccccc1Cl)-c1ccc(Cl)cc1)C(N)=O Show InChI InChI=1S/C25H25Cl2N7O/c1-2-31-25(24(28)35)11-13-33(14-12-25)22-20-23(30-15-29-22)34(17-9-7-16(26)8-10-17)21(32-20)18-5-3-4-6-19(18)27/h3-10,15,31H,2,11-14H2,1H3,(H2,28,35) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 7.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461693
(CHEMBL4228096)Show SMILES Clc1ccc(cc1)-n1c(nc2c(ncnc12)N1CCN(CC1)c1ccccc1)-c1ccccc1Cl Show InChI InChI=1S/C27H22Cl2N6/c28-19-10-12-21(13-11-19)35-25(22-8-4-5-9-23(22)29)32-24-26(30-18-31-27(24)35)34-16-14-33(15-17-34)20-6-2-1-3-7-20/h1-13,18H,14-17H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50461690
(CHEMBL4225671)Show SMILES COc1ccc(CN2CCN(CC2)c2ncnc3n(c(nc23)-c2ccccc2Cl)-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C29H26Cl2N6O/c1-38-23-12-6-20(7-13-23)18-35-14-16-36(17-15-35)28-26-29(33-19-32-28)37(22-10-8-21(30)9-11-22)27(34-26)24-4-2-3-5-25(24)31/h2-13,19H,14-18H2,1H3 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
RTI International
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 expressed in CHOK1 cell membranes |
J Med Chem 61: 4370-4385 (2018)
Article DOI: 10.1021/acs.jmedchem.7b01820
BindingDB Entry DOI: 10.7270/Q20004QP |
More data for this
Ligand-Target Pair | |
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