Found 30 hits of Enzyme Inhibition Constant Data 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)) | BDBM50303835
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES CN(C)CCCN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:6.5,c:23| Show InChI InChI=1S/C27H29Cl2N5O2S/c1-33(2)18-6-17-30-27(32-37(35,36)24-15-13-23(29)14-16-24)34-19-25(20-7-4-3-5-8-20)26(31-34)21-9-11-22(28)12-10-21/h3-5,7-16,25H,6,17-19H2,1-2H3,(H,30,32) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303837
(CHEMBL570623 | [3-(4-Chlorophenyl)-4-phenyl-4,5-di...)Show SMILES CN(C)CCN1CCN(CC1)C(=NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:12.13,c:28| Show InChI InChI=1S/C30H34Cl2N6O2S/c1-35(2)16-17-36-18-20-37(21-19-36)30(34-41(39,40)27-14-12-26(32)13-15-27)38-22-28(23-6-4-3-5-7-23)29(33-38)24-8-10-25(31)11-9-24/h3-15,28H,16-22H2,1-2H3 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303844
(1-(4-Chlorophenyl)-2-(2-chlorophenyl)-5-ethyl-N-(p...)Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NN1CCCCC1 Show InChI InChI=1S/C23H24Cl2N4O/c1-2-20-21(23(30)27-28-14-6-3-7-15-28)26-22(18-8-4-5-9-19(18)25)29(20)17-12-10-16(24)11-13-17/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,27,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303836
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES CN1CCC(CC1)N=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:7.7,c:25| Show InChI InChI=1S/C28H29Cl2N5O2S/c1-34-17-15-24(16-18-34)31-28(33-38(36,37)25-13-11-23(30)12-14-25)35-19-26(20-5-3-2-4-6-20)27(32-35)21-7-9-22(29)10-8-21/h2-14,24,26H,15-19H2,1H3,(H,31,33) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
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
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM29094
((+/-)-SLV319 | (S)-3-(4-chlorophenyl)-N-(4-chlorop...)Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18| Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-13-11-19(25)12-14-20)29-15-21(16-5-3-2-4-6-16)22(27-29)17-7-9-18(24)10-8-17/h2-14,21H,15H2,1H3,(H,26,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303838
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(NS(=O)(=O)c1ccc(Cl)cc1)=NCCCCN1CCCC1 |w:30.34,t:8| Show InChI InChI=1S/C30H33Cl2N5O2S/c31-25-12-10-24(11-13-25)29-28(23-8-2-1-3-9-23)22-37(34-29)30(33-18-4-5-19-36-20-6-7-21-36)35-40(38,39)27-16-14-26(32)15-17-27/h1-3,8-17,28H,4-7,18-22H2,(H,33,35) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303846
(CHEMBL585736 | [3-(4-Chlorophenyl)-4-phenyl-4,5-di...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=NS(=O)(=O)c1ccc(Cl)cc1)N1CCS(=O)(=O)CC1 |w:19.22,t:8| Show InChI InChI=1S/C26H24Cl2N4O4S2/c27-21-8-6-20(7-9-21)25-24(19-4-2-1-3-5-19)18-32(29-25)26(31-14-16-37(33,34)17-15-31)30-38(35,36)23-12-10-22(28)11-13-23/h1-13,24H,14-18H2 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303839
(4-Chloro-N-{[3-(4-chlorophenyl)-4-phenyl-4,5-dihyd...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(NS(=O)(=O)c1ccc(Cl)cc1)=NCCCCNc1c2CCCCc2nc2ccccc12 |w:30.34,t:8| Show InChI InChI=1S/C39H38Cl2N6O2S/c40-29-18-16-28(17-19-29)37-34(27-10-2-1-3-11-27)26-47(45-37)39(46-50(48,49)31-22-20-30(41)21-23-31)43-25-9-8-24-42-38-32-12-4-6-14-35(32)44-36-15-7-5-13-33(36)38/h1-4,6,10-12,14,16-23,34H,5,7-9,13,15,24-26H2,(H,42,44)(H,43,46) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303845
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES CC(C)(O)CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:5.4,c:22| Show InChI InChI=1S/C26H26Cl2N4O3S/c1-26(2,33)17-29-25(31-36(34,35)22-14-12-21(28)13-15-22)32-16-23(18-6-4-3-5-7-18)24(30-32)19-8-10-20(27)11-9-19/h3-15,23,33H,16-17H2,1-2H3,(H,29,31) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303841
(CHEMBL570159 | N-[4-(1,2,3,4-Tetrahydroacridin-9-y...)Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C35H35Cl2N5O/c1-2-31-33(41-34(25-11-3-6-14-28(25)37)42(31)24-19-17-23(36)18-20-24)35(43)39-22-10-9-21-38-32-26-12-4-7-15-29(26)40-30-16-8-5-13-27(30)32/h3-4,6-7,11-12,14-15,17-20H,2,5,8-10,13,16,21-22H2,1H3,(H,38,40)(H,39,43) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 48 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303840
(4-Chloro-N-{[3-(4-chlorophenyl)-4-phenyl-4,5-dihyd...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(NS(=O)(=O)c1ccc(Cl)cc1)=NCCCCCCCNc1c2CCCCc2nc2ccccc12 |w:30.34,t:8| Show InChI InChI=1S/C42H44Cl2N6O2S/c43-32-21-19-31(20-22-32)40-37(30-13-5-4-6-14-30)29-50(48-40)42(49-53(51,52)34-25-23-33(44)24-26-34)46-28-12-3-1-2-11-27-45-41-35-15-7-9-17-38(35)47-39-18-10-8-16-36(39)41/h4-7,9,13-15,17,19-26,37H,1-3,8,10-12,16,18,27-29H2,(H,45,47)(H,46,49) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 54 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303842
(CHEMBL567532 | N-[7-(1,2,3,4-Tetrahydroacridin-9-y...)Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C38H41Cl2N5O/c1-2-34-36(44-37(28-14-6-9-17-31(28)40)45(34)27-22-20-26(39)21-23-27)38(46)42-25-13-5-3-4-12-24-41-35-29-15-7-10-18-32(29)43-33-19-11-8-16-30(33)35/h6-7,9-10,14-15,17-18,20-23H,2-5,8,11-13,16,19,24-25H2,1H3,(H,41,43)(H,42,46) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 88 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303846
(CHEMBL585736 | [3-(4-Chlorophenyl)-4-phenyl-4,5-di...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(=NS(=O)(=O)c1ccc(Cl)cc1)N1CCS(=O)(=O)CC1 |w:19.22,t:8| Show InChI InChI=1S/C26H24Cl2N4O4S2/c27-21-8-6-20(7-9-21)25-24(19-4-2-1-3-5-19)18-32(29-25)26(31-14-16-37(33,34)17-15-31)30-38(35,36)23-12-10-22(28)11-13-23/h1-13,24H,14-18H2 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 571 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50303843
(5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl...)Show SMILES CCC(=O)N(CCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C40H48Cl3N5O2/c1-3-37(49)47(34-21-26-46(27-22-34)25-20-30-12-8-7-9-13-30)24-11-6-4-5-10-23-44-40(50)38-29(2)39(31-14-16-32(41)17-15-31)48(45-38)36-19-18-33(42)28-35(36)43/h7-9,12-19,28,34H,3-6,10-11,20-27H2,1-2H3,(H,44,50) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 701 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Binding affinity to CB1 receptor |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303840
(4-Chloro-N-{[3-(4-chlorophenyl)-4-phenyl-4,5-dihyd...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(NS(=O)(=O)c1ccc(Cl)cc1)=NCCCCCCCNc1c2CCCCc2nc2ccccc12 |w:30.34,t:8| Show InChI InChI=1S/C42H44Cl2N6O2S/c43-32-21-19-31(20-22-32)40-37(30-13-5-4-6-14-30)29-50(48-40)42(49-53(51,52)34-25-23-33(44)24-26-34)46-28-12-3-1-2-11-27-45-41-35-15-7-9-17-38(35)47-39-18-10-8-16-36(39)41/h4-7,9,13-15,17,19-26,37H,1-3,8,10-12,16,18,27-29H2,(H,45,47)(H,46,49) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM8961
(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) | PDB
NCI pathway
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303841
(CHEMBL570159 | N-[4-(1,2,3,4-Tetrahydroacridin-9-y...)Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NCCCCNc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C35H35Cl2N5O/c1-2-31-33(41-34(25-11-3-6-14-28(25)37)42(31)24-19-17-23(36)18-20-24)35(43)39-22-10-9-21-38-32-26-12-4-7-15-29(26)40-30-16-8-5-13-27(30)32/h3-4,6-7,11-12,14-15,17-20H,2,5,8-10,13,16,21-22H2,1H3,(H,38,40)(H,39,43) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303844
(1-(4-Chlorophenyl)-2-(2-chlorophenyl)-5-ethyl-N-(p...)Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NN1CCCCC1 Show InChI InChI=1S/C23H24Cl2N4O/c1-2-20-21(23(30)27-28-14-6-3-7-15-28)26-22(18-8-4-5-9-19(18)25)29(20)17-12-10-16(24)11-13-17/h4-5,8-13H,2-3,6-7,14-15H2,1H3,(H,27,30) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303839
(4-Chloro-N-{[3-(4-chlorophenyl)-4-phenyl-4,5-dihyd...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(NS(=O)(=O)c1ccc(Cl)cc1)=NCCCCNc1c2CCCCc2nc2ccccc12 |w:30.34,t:8| Show InChI InChI=1S/C39H38Cl2N6O2S/c40-29-18-16-28(17-19-29)37-34(27-10-2-1-3-11-27)26-47(45-37)39(46-50(48,49)31-22-20-30(41)21-23-31)43-25-9-8-24-42-38-32-12-4-6-14-35(32)44-36-15-7-5-13-33(36)38/h1-4,6,10-12,14,16-23,34H,5,7-9,13,15,24-26H2,(H,42,44)(H,43,46) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303845
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES CC(C)(O)CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:5.4,c:22| Show InChI InChI=1S/C26H26Cl2N4O3S/c1-26(2,33)17-29-25(31-36(34,35)22-14-12-21(28)13-15-22)32-16-23(18-6-4-3-5-7-18)24(30-32)19-8-10-20(27)11-9-19/h3-15,23,33H,16-17H2,1-2H3,(H,29,31) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303842
(CHEMBL567532 | N-[7-(1,2,3,4-Tetrahydroacridin-9-y...)Show SMILES CCc1c(nc(-c2ccccc2Cl)n1-c1ccc(Cl)cc1)C(=O)NCCCCCCCNc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C38H41Cl2N5O/c1-2-34-36(44-37(28-14-6-9-17-31(28)40)45(34)27-22-20-26(39)21-23-27)38(46)42-25-13-5-3-4-12-24-41-35-29-15-7-10-18-32(29)43-33-19-11-8-16-30(33)35/h6-7,9-10,14-15,17-18,20-23H,2-5,8,11-13,16,19,24-25H2,1H3,(H,41,43)(H,42,46) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303836
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES CN1CCC(CC1)N=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:7.7,c:25| Show InChI InChI=1S/C28H29Cl2N5O2S/c1-34-17-15-24(16-18-34)31-28(33-38(36,37)25-13-11-23(30)12-14-25)35-19-26(20-5-3-2-4-6-20)27(32-35)21-7-9-22(29)10-8-21/h2-14,24,26H,15-19H2,1H3,(H,31,33) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303838
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES Clc1ccc(cc1)C1=NN(CC1c1ccccc1)C(NS(=O)(=O)c1ccc(Cl)cc1)=NCCCCN1CCCC1 |w:30.34,t:8| Show InChI InChI=1S/C30H33Cl2N5O2S/c31-25-12-10-24(11-13-25)29-28(23-8-2-1-3-9-23)22-37(34-29)30(33-18-4-5-19-36-20-6-7-21-36)35-40(38,39)27-16-14-26(32)15-17-27/h1-3,8-17,28H,4-7,18-22H2,(H,33,35) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM8961
(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303835
(3-(4-Chlorophenyl)-N'-((4-chlorophenyl)sulfonyl)-N...)Show SMILES CN(C)CCCN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:6.5,c:23| Show InChI InChI=1S/C27H29Cl2N5O2S/c1-33(2)18-6-17-30-27(32-37(35,36)24-15-13-23(29)14-16-24)34-19-25(20-7-4-3-5-8-20)26(31-34)21-9-11-22(28)12-10-21/h3-5,7-16,25H,6,17-19H2,1-2H3,(H,30,32) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM29094
((+/-)-SLV319 | (S)-3-(4-chlorophenyl)-N-(4-chlorop...)Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:18| Show InChI InChI=1S/C23H20Cl2N4O2S/c1-26-23(28-32(30,31)20-13-11-19(25)12-14-20)29-15-21(16-5-3-2-4-6-16)22(27-29)17-7-9-18(24)10-8-17/h2-14,21H,15H2,1H3,(H,26,28) | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50303837
(CHEMBL570623 | [3-(4-Chlorophenyl)-4-phenyl-4,5-di...)Show SMILES CN(C)CCN1CCN(CC1)C(=NS(=O)(=O)c1ccc(Cl)cc1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:12.13,c:28| Show InChI InChI=1S/C30H34Cl2N6O2S/c1-35(2)16-17-36-18-20-37(21-19-36)30(34-41(39,40)27-14-12-26(32)13-15-27)38-22-28(23-6-4-3-5-7-23)29(33-38)24-8-10-25(31)11-9-24/h3-15,28H,16-22H2,1-2H3 | PDB
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| >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(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
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| 1.58E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50303843
(5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl...)Show SMILES CCC(=O)N(CCCCCCCNC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C40H48Cl3N5O2/c1-3-37(49)47(34-21-26-46(27-22-34)25-20-30-12-8-7-9-13-30)24-11-6-4-5-10-23-44-40(50)38-29(2)39(31-14-16-32(41)17-15-31)48(45-38)36-19-18-33(42)28-35(36)43/h7-9,12-19,28,34H,3-6,10-11,20-27H2,1-2H3,(H,44,50) | PDB
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| 6.54E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Solvay Pharma
Curated by ChEMBL
| Assay Description
Binding affinity to mu opioid receptor |
J Med Chem 53: 1338-46 (2010)
Article DOI: 10.1021/jm901614b
BindingDB Entry DOI: 10.7270/Q2WQ03WT |
More data for this
Ligand-Target Pair | |
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