Found 12 hits Enz. Inhib. hit(s) with all data for entry = 50030716 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)) | BDBM50300458
(3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1-yls...)Show SMILES CN=C(NS(=O)(=O)N1CCC(F)(F)CC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:19| Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)30-15-19(16-5-3-2-4-6-16)20(27-30)17-7-9-18(23)10-8-17/h2-10,19H,11-15H2,1H3,(H,26,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 12.2 | 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]CP-55940 from human CB1 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
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
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]CP-55940 from human CB1 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50300455
(3-(4-chlorophenyl)-N'-(4-chlorophenylsulfonyl)-N-m...)Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:19| Show InChI InChI=1S/C24H22Cl2N4O2S/c1-27-24(29-33(31,32)21-13-11-20(26)12-14-21)30-16-15-22(17-5-3-2-4-6-17)23(28-30)18-7-9-19(25)10-8-18/h2-14,22H,15-16H2,1H3,(H,27,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
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]CP-55940 from human CB1 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50300457
(3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1-yls...)Show SMILES CNC(=NS(=O)(=O)N1CCC(F)(F)CC1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:20| Show InChI InChI=1S/C23H26ClF2N5O2S/c1-27-22(29-34(32,33)30-15-12-23(25,26)13-16-30)31-14-11-20(17-5-3-2-4-6-17)21(28-31)18-7-9-19(24)10-8-18/h2-10,20H,11-16H2,1H3,(H,27,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 47 | 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]CP-55940 from human CB1 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50300456
(3-(4-chlorophenyl)-N-methyl-4-phenyl-N'-(piperidin...)Show SMILES CNC(=NS(=O)(=O)N1CCCCC1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:18| Show InChI InChI=1S/C23H28ClN5O2S/c1-25-23(27-32(30,31)28-15-6-3-7-16-28)29-17-14-21(18-8-4-2-5-9-18)22(26-29)19-10-12-20(24)13-11-19/h2,4-5,8-13,21H,3,6-7,14-17H2,1H3,(H,25,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 74 | 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]CP-55940 from human CB1 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50172898
(3,4-diarylpyrazoline derivative | 3-(4-chloropheny...)Show SMILES CN=C(NS(=O)(=O)N1CCCCC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:17| Show InChI InChI=1S/C22H26ClN5O2S/c1-24-22(26-31(29,30)27-14-6-3-7-15-27)28-16-20(17-8-4-2-5-9-17)21(25-28)18-10-12-19(23)13-11-18/h2,4-5,8-13,20H,3,6-7,14-16H2,1H3,(H,24,26) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 152 | 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]CP-55940 from human CB1 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50300458
(3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1-yls...)Show SMILES CN=C(NS(=O)(=O)N1CCC(F)(F)CC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:19| Show InChI InChI=1S/C22H24ClF2N5O2S/c1-26-21(28-33(31,32)29-13-11-22(24,25)12-14-29)30-15-19(16-5-3-2-4-6-16)20(27-30)17-7-9-18(23)10-8-17/h2-10,19H,11-15H2,1H3,(H,26,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 219 | 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]CP-55940 from human CB2 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50300457
(3-(4-chlorophenyl)-N'-(4,4-difluoropiperidin-1-yls...)Show SMILES CNC(=NS(=O)(=O)N1CCC(F)(F)CC1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:20| Show InChI InChI=1S/C23H26ClF2N5O2S/c1-27-22(29-34(32,33)30-15-12-23(25,26)13-16-30)31-14-11-20(17-5-3-2-4-6-17)21(28-31)18-7-9-19(24)10-8-18/h2-10,20H,11-16H2,1H3,(H,27,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 247 | 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]CP-55940 from human CB2 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50300455
(3-(4-chlorophenyl)-N'-(4-chlorophenylsulfonyl)-N-m...)Show SMILES CN=C(NS(=O)(=O)c1ccc(Cl)cc1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:19| Show InChI InChI=1S/C24H22Cl2N4O2S/c1-27-24(29-33(31,32)21-13-11-20(26)12-14-21)30-16-15-22(17-5-3-2-4-6-17)23(28-30)18-7-9-19(25)10-8-18/h2-14,22H,15-16H2,1H3,(H,27,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 318 | 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]CP-55940 from human CB2 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50300456
(3-(4-chlorophenyl)-N-methyl-4-phenyl-N'-(piperidin...)Show SMILES CNC(=NS(=O)(=O)N1CCCCC1)N1CCC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:3.3,c:18| Show InChI InChI=1S/C23H28ClN5O2S/c1-25-23(27-32(30,31)28-15-6-3-7-16-28)29-17-14-21(18-8-4-2-5-9-18)22(26-29)19-10-12-20(24)13-11-19/h2,4-5,8-13,21H,3,6-7,14-17H2,1H3,(H,25,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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]CP-55940 from human CB2 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
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
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
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]CP-55940 from human CB2 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50172898
(3,4-diarylpyrazoline derivative | 3-(4-chloropheny...)Show SMILES CN=C(NS(=O)(=O)N1CCCCC1)N1CC(C(=N1)c1ccc(Cl)cc1)c1ccccc1 |w:1.0,c:17| Show InChI InChI=1S/C22H26ClN5O2S/c1-24-22(26-31(29,30)27-14-6-3-7-15-27)28-16-20(17-8-4-2-5-9-17)21(25-28)18-10-12-19(23)13-11-18/h2,4-5,8-13,20H,3,6-7,14-16H2,1H3,(H,24,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.32E+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]CP-55940 from human CB2 receptor expressed in CHO cells |
Bioorg Med Chem Lett 19: 5675-8 (2009)
Article DOI: 10.1016/j.bmcl.2009.08.007
BindingDB Entry DOI: 10.7270/Q2J67H0H |
More data for this
Ligand-Target Pair | |
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