Found 71 hits Enz. Inhib. hit(s) with all data for entry = 50039755 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)) | BDBM50383388
(CHEMBL2030738)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(C(N)=O)c1ccccc1 Show InChI InChI=1S/C29H25Cl3N4O2/c1-18-25(27(37)35-15-13-29(14-16-35,28(33)38)20-5-3-2-4-6-20)34-36(24-12-11-22(31)17-23(24)32)26(18)19-7-9-21(30)10-8-19/h2-12,17H,13-16H2,1H3,(H2,33,38) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]SR141716 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383402
(CHEMBL2030754)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NC1CCN(CC1)C(=O)OC(C)(C)C Show InChI InChI=1S/C27H29Cl3N4O3/c1-16-23(25(35)31-20-11-13-33(14-12-20)26(36)37-27(2,3)4)32-34(22-10-9-19(29)15-21(22)30)24(16)17-5-7-18(28)8-6-17/h5-10,15,20H,11-14H2,1-4H3,(H,31,35) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383388
(CHEMBL2030738)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(C(N)=O)c1ccccc1 Show InChI InChI=1S/C29H25Cl3N4O2/c1-18-25(27(37)35-15-13-29(14-16-35,28(33)38)20-5-3-2-4-6-20)34-36(24-12-11-22(31)17-23(24)32)26(18)19-7-9-21(30)10-8-19/h2-12,17H,13-16H2,1H3,(H2,33,38) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 3.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
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
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| 6.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383386
(CHEMBL2029362)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NS(C)(=O)=O)c1ccccc1 Show InChI InChI=1S/C29H27Cl3N4O3S/c1-19-26(28(37)35-16-14-29(15-17-35,34-40(2,38)39)21-6-4-3-5-7-21)33-36(25-13-12-23(31)18-24(25)32)27(19)20-8-10-22(30)11-9-20/h3-13,18,34H,14-17H2,1-2H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383399
(CHEMBL2030751)Show SMILES CCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C32H32Cl3N5O2/c1-3-17-36-31(42)37-32(23-7-5-4-6-8-23)15-18-39(19-16-32)30(41)28-21(2)29(22-9-11-24(33)12-10-22)40(38-28)27-14-13-25(34)20-26(27)35/h4-14,20H,3,15-19H2,1-2H3,(H2,36,37,42) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383387
(CHEMBL2030765)Show SMILES CCOC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C25H25Cl3N4O3/c1-3-35-25(34)31-12-10-19(11-13-31)29-24(33)22-15(2)23(16-4-6-17(26)7-5-16)32(30-22)21-9-8-18(27)14-20(21)28/h4-9,14,19H,3,10-13H2,1-2H3,(H,29,33) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 9.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383413
(CHEMBL2030933)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CCCN(C1)S(C)(=O)=O |r| Show InChI InChI=1S/C23H23Cl3N4O3S/c1-14-21(23(31)27-18-4-3-11-29(13-18)34(2,32)33)28-30(20-10-9-17(25)12-19(20)26)22(14)15-5-7-16(24)8-6-15/h5-10,12,18H,3-4,11,13H2,1-2H3,(H,27,31)/t18-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 11.8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383397
(CHEMBL2030749)Show SMILES CC(C)NC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C32H32Cl3N5O2/c1-20(2)36-31(42)37-32(23-7-5-4-6-8-23)15-17-39(18-16-32)30(41)28-21(3)29(22-9-11-24(33)12-10-22)40(38-28)27-14-13-25(34)19-26(27)35/h4-14,19-20H,15-18H2,1-3H3,(H2,36,37,42) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 13.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383404
(CHEMBL2030759)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NC1CCN(CC1)C(=O)NC(C)(C)C Show InChI InChI=1S/C27H30Cl3N5O2/c1-16-23(25(36)31-20-11-13-34(14-12-20)26(37)32-27(2,3)4)33-35(22-10-9-19(29)15-21(22)30)24(16)17-5-7-18(28)8-6-17/h5-10,15,20H,11-14H2,1-4H3,(H,31,36)(H,32,37) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 14.7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383398
(CHEMBL2030750)Show SMILES CCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C31H30Cl3N5O2/c1-3-35-30(41)36-31(22-7-5-4-6-8-22)15-17-38(18-16-31)29(40)27-20(2)28(21-9-11-23(32)12-10-21)39(37-27)26-14-13-24(33)19-25(26)34/h4-14,19H,3,15-18H2,1-2H3,(H2,35,36,41) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383401
(CHEMBL2030753)Show SMILES CCCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C33H34Cl3N5O2/c1-3-4-18-37-32(43)38-33(24-8-6-5-7-9-24)16-19-40(20-17-33)31(42)29-22(2)30(23-10-12-25(34)13-11-23)41(39-29)28-15-14-26(35)21-27(28)36/h5-15,21H,3-4,16-20H2,1-2H3,(H2,37,38,43) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 15.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383417
(CHEMBL2030939)Show SMILES CCOC(=O)N1CCC[C@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C25H25Cl3N4O3/c1-3-35-25(34)31-12-4-5-19(14-31)29-24(33)22-15(2)23(16-6-8-17(26)9-7-16)32(30-22)21-11-10-18(27)13-20(21)28/h6-11,13,19H,3-5,12,14H2,1-2H3,(H,29,33)/t19-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 17.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383412
(CHEMBL2030930)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CCCN(C1)C(=O)OC(C)(C)C |r| Show InChI InChI=1S/C27H29Cl3N4O3/c1-16-23(25(35)31-20-6-5-13-33(15-20)26(36)37-27(2,3)4)32-34(22-12-11-19(29)14-21(22)30)24(16)17-7-9-18(28)10-8-17/h7-12,14,20H,5-6,13,15H2,1-4H3,(H,31,35)/t20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 22.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383396
(CHEMBL2030748)Show SMILES CCCCCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C35H38Cl3N5O2/c1-3-4-5-9-20-39-34(45)40-35(26-10-7-6-8-11-26)18-21-42(22-19-35)33(44)31-24(2)32(25-12-14-27(36)15-13-25)43(41-31)30-17-16-28(37)23-29(30)38/h6-8,10-17,23H,3-5,9,18-22H2,1-2H3,(H2,39,40,45) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 38.8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383408
(CHEMBL2030768)Show SMILES CC(=O)N1CCC[C@@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C24H23Cl3N4O2/c1-14-22(24(33)28-19-4-3-11-30(13-19)15(2)32)29-31(21-10-9-18(26)12-20(21)27)23(14)16-5-7-17(25)8-6-16/h5-10,12,19H,3-4,11,13H2,1-2H3,(H,28,33)/t19-/m0/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 39.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383386
(CHEMBL2029362)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NS(C)(=O)=O)c1ccccc1 Show InChI InChI=1S/C29H27Cl3N4O3S/c1-19-26(28(37)35-16-14-29(15-17-35,34-40(2,38)39)21-6-4-3-5-7-21)33-36(25-13-12-23(31)18-24(25)32)27(19)20-8-10-22(30)11-9-20/h3-13,18,34H,14-17H2,1-2H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 41 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383390
(CHEMBL2030740)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)OC(C)(C)C)c1ccccc1 Show InChI InChI=1S/C33H33Cl3N4O3/c1-21-28(38-40(27-15-14-25(35)20-26(27)36)29(21)22-10-12-24(34)13-11-22)30(41)39-18-16-33(17-19-39,23-8-6-5-7-9-23)37-31(42)43-32(2,3)4/h5-15,20H,16-19H2,1-4H3,(H,37,42) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 42.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383393
(CHEMBL2030744)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)NCc1ccccc1)c1ccccc1 Show InChI InChI=1S/C36H32Cl3N5O2/c1-24-32(42-44(31-17-16-29(38)22-30(31)39)33(24)26-12-14-28(37)15-13-26)34(45)43-20-18-36(19-21-43,27-10-6-3-7-11-27)41-35(46)40-23-25-8-4-2-5-9-25/h2-17,22H,18-21,23H2,1H3,(H2,40,41,46) | 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 |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383392
(CHEMBL2030743)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)NC(C)(C)C)c1ccccc1 Show InChI InChI=1S/C33H34Cl3N5O2/c1-21-28(39-41(27-15-14-25(35)20-26(27)36)29(21)22-10-12-24(34)13-11-22)30(42)40-18-16-33(17-19-40,23-8-6-5-7-9-23)38-31(43)37-32(2,3)4/h5-15,20H,16-19H2,1-4H3,(H2,37,38,43) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 47.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383391
(CHEMBL2030742)Show SMILES CC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C30H27Cl3N4O2/c1-19-27(29(39)36-16-14-30(15-17-36,34-20(2)38)22-6-4-3-5-7-22)35-37(26-13-12-24(32)18-25(26)33)28(19)21-8-10-23(31)11-9-21/h3-13,18H,14-17H2,1-2H3,(H,34,38) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 62.6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383403
(CHEMBL2030756)Show SMILES CC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C24H23Cl3N4O2/c1-14-22(24(33)28-19-9-11-30(12-10-19)15(2)32)29-31(21-8-7-18(26)13-20(21)27)23(14)16-3-5-17(25)6-4-16/h3-8,13,19H,9-12H2,1-2H3,(H,28,33) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 65.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383411
(CHEMBL2030929)Show SMILES CCOC(=O)N1CCC[C@@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C25H25Cl3N4O3/c1-3-35-25(34)31-12-4-5-19(14-31)29-24(33)22-15(2)23(16-6-8-17(26)9-7-16)32(30-22)21-11-10-18(27)13-20(21)28/h6-11,13,19H,3-5,12,14H2,1-2H3,(H,29,33)/t19-/m0/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 65.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383409
(CHEMBL2030769)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N[C@H]1CCCN(C1)S(C)(=O)=O |r| Show InChI InChI=1S/C23H23Cl3N4O3S/c1-14-21(23(31)27-18-4-3-11-29(13-18)34(2,32)33)28-30(20-10-9-17(25)12-19(20)26)22(14)15-5-7-16(24)8-6-15/h5-10,12,18H,3-4,11,13H2,1-2H3,(H,27,31)/t18-/m0/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 77.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383389
(CHEMBL2030739)Show SMILES CCNC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(N)=O Show InChI InChI=1S/C25H26Cl3N5O2/c1-3-30-25(24(29)35)10-12-32(13-11-25)23(34)21-15(2)22(16-4-6-17(26)7-5-16)33(31-21)20-9-8-18(27)14-19(20)28/h4-9,14,30H,3,10-13H2,1-2H3,(H2,29,35) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 78.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383406
(CHEMBL2030762)Show SMILES CC(C)NC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C26H28Cl3N5O2/c1-15(2)30-26(36)33-12-10-20(11-13-33)31-25(35)23-16(3)24(17-4-6-18(27)7-5-17)34(32-23)22-9-8-19(28)14-21(22)29/h4-9,14-15,20H,10-13H2,1-3H3,(H,30,36)(H,31,35) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 86 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383414
(CHEMBL2030935)Show SMILES CC(C)NC(=O)N1CCC[C@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C26H28Cl3N5O2/c1-15(2)30-26(36)33-12-4-5-20(14-33)31-25(35)23-16(3)24(17-6-8-18(27)9-7-17)34(32-23)22-11-10-19(28)13-21(22)29/h6-11,13,15,20H,4-5,12,14H2,1-3H3,(H,30,36)(H,31,35)/t20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 97 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383384
(CHEMBL2030741)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(N)(CC1)c1ccccc1 Show InChI InChI=1S/C28H25Cl3N4O/c1-18-25(27(36)34-15-13-28(32,14-16-34)20-5-3-2-4-6-20)33-35(24-12-11-22(30)17-23(24)31)26(18)19-7-9-21(29)10-8-19/h2-12,17H,13-16,32H2,1H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 104 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383416
(CHEMBL2030937)Show SMILES CCCCNC(=O)N1CCC[C@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C27H30Cl3N5O2/c1-3-4-13-31-27(37)34-14-5-6-21(16-34)32-26(36)24-17(2)25(18-7-9-19(28)10-8-18)35(33-24)23-12-11-20(29)15-22(23)30/h7-12,15,21H,3-6,13-14,16H2,1-2H3,(H,31,37)(H,32,36)/t21-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 125 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383415
(CHEMBL2030936)Show SMILES CCCNC(=O)N1CCC[C@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C26H28Cl3N5O2/c1-3-12-30-26(36)33-13-4-5-20(15-33)31-25(35)23-16(2)24(17-6-8-18(27)9-7-17)34(32-23)22-11-10-19(28)14-21(22)29/h6-11,14,20H,3-5,12-13,15H2,1-2H3,(H,30,36)(H,31,35)/t20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 134 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383405
(CHEMBL2030761)Show SMILES CCNC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C25H26Cl3N5O2/c1-3-29-25(35)32-12-10-19(11-13-32)30-24(34)22-15(2)23(16-4-6-17(26)7-5-16)33(31-22)21-9-8-18(27)14-20(21)28/h4-9,14,19H,3,10-13H2,1-2H3,(H,29,35)(H,30,34) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 165 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383398
(CHEMBL2030750)Show SMILES CCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C31H30Cl3N5O2/c1-3-35-30(41)36-31(22-7-5-4-6-8-22)15-17-38(18-16-31)29(40)27-20(2)28(21-9-11-23(32)12-10-21)39(37-27)26-14-13-24(33)19-25(26)34/h4-14,19H,3,15-18H2,1-2H3,(H2,35,36,41) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 182 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383407
(CHEMBL2030763)Show SMILES CCCNC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C26H28Cl3N5O2/c1-3-12-30-26(36)33-13-10-20(11-14-33)31-25(35)23-16(2)24(17-4-6-18(27)7-5-17)34(32-23)22-9-8-19(28)15-21(22)29/h4-9,15,20H,3,10-14H2,1-2H3,(H,30,36)(H,31,35) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 184 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383385
(CHEMBL2030764)Show SMILES CCCCNC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C27H30Cl3N5O2/c1-3-4-13-31-27(37)34-14-11-21(12-15-34)32-26(36)24-17(2)25(18-5-7-19(28)8-6-18)35(33-24)23-10-9-20(29)16-22(23)30/h5-10,16,21H,3-4,11-15H2,1-2H3,(H,31,37)(H,32,36) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 187 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383391
(CHEMBL2030742)Show SMILES CC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C30H27Cl3N4O2/c1-19-27(29(39)36-16-14-30(15-17-36,34-20(2)38)22-6-4-3-5-7-22)35-37(26-13-12-24(32)18-25(26)33)28(19)21-8-10-23(31)11-9-21/h3-13,18H,14-17H2,1-2H3,(H,34,38) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 214 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383410
(CHEMBL2030926)Show SMILES CCCNC(=O)N1CCC[C@@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C26H28Cl3N5O2/c1-3-12-30-26(36)33-13-4-5-20(15-33)31-25(35)23-16(2)24(17-6-8-18(27)9-7-17)34(32-23)22-11-10-19(28)14-21(22)29/h6-11,14,20H,3-5,12-13,15H2,1-2H3,(H,30,36)(H,31,35)/t20-/m0/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 271 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383399
(CHEMBL2030751)Show SMILES CCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C32H32Cl3N5O2/c1-3-17-36-31(42)37-32(23-7-5-4-6-8-23)15-18-39(19-16-32)30(41)28-21(2)29(22-9-11-24(33)12-10-22)40(38-28)27-14-13-25(34)20-26(27)35/h4-14,20H,3,15-19H2,1-2H3,(H2,36,37,42) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 293 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
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
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| 313 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383394
(CHEMBL2030746)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)Nc1ccc(F)cc1)c1ccccc1 Show InChI InChI=1S/C35H29Cl3FN5O2/c1-22-31(42-44(30-16-11-26(37)21-29(30)38)32(22)23-7-9-25(36)10-8-23)33(45)43-19-17-35(18-20-43,24-5-3-2-4-6-24)41-34(46)40-28-14-12-27(39)13-15-28/h2-16,21H,17-20H2,1H3,(H2,40,41,46) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 614 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383400
(CHEMBL2030752)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)NC1CCCCC1)c1ccccc1 Show InChI InChI=1S/C35H36Cl3N5O2/c1-23-31(41-43(30-17-16-27(37)22-29(30)38)32(23)24-12-14-26(36)15-13-24)33(44)42-20-18-35(19-21-42,25-8-4-2-5-9-25)40-34(45)39-28-10-6-3-7-11-28/h2,4-5,8-9,12-17,22,28H,3,6-7,10-11,18-21H2,1H3,(H2,39,40,45) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 792 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383384
(CHEMBL2030741)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(N)(CC1)c1ccccc1 Show InChI InChI=1S/C28H25Cl3N4O/c1-18-25(27(36)34-15-13-28(32,14-16-34)20-5-3-2-4-6-20)33-35(24-12-11-22(30)17-23(24)31)26(18)19-7-9-21(29)10-8-19/h2-12,17H,13-16,32H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.13E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383413
(CHEMBL2030933)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N[C@@H]1CCCN(C1)S(C)(=O)=O |r| Show InChI InChI=1S/C23H23Cl3N4O3S/c1-14-21(23(31)27-18-4-3-11-29(13-18)34(2,32)33)28-30(20-10-9-17(25)12-19(20)26)22(14)15-5-7-16(24)8-6-15/h5-10,12,18H,3-4,11,13H2,1-2H3,(H,27,31)/t18-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.25E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50383395
(CHEMBL2030747)Show SMILES CN(C)c1ccc(NC(=O)NC2(CCN(CC2)C(=O)c2nn(c(c2C)-c2ccc(Cl)cc2)-c2ccc(Cl)cc2Cl)c2ccccc2)cc1 Show InChI InChI=1S/C37H35Cl3N6O2/c1-24-33(43-46(32-18-13-28(39)23-31(32)40)34(24)25-9-11-27(38)12-10-25)35(47)45-21-19-37(20-22-45,26-7-5-4-6-8-26)42-36(48)41-29-14-16-30(17-15-29)44(2)3/h4-18,23H,19-22H2,1-3H3,(H2,41,42,48) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383390
(CHEMBL2030740)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(NC(=O)OC(C)(C)C)c1ccccc1 Show InChI InChI=1S/C33H33Cl3N4O3/c1-21-28(38-40(27-15-14-25(35)20-26(27)36)29(21)22-10-12-24(34)13-11-22)30(41)39-18-16-33(17-19-39,23-8-6-5-7-9-23)37-31(42)43-32(2,3)4/h5-15,20H,16-19H2,1-4H3,(H,37,42) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.11E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383389
(CHEMBL2030739)Show SMILES CCNC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(N)=O Show InChI InChI=1S/C25H26Cl3N5O2/c1-3-30-25(24(29)35)10-12-32(13-11-25)23(34)21-15(2)22(16-4-6-17(26)7-5-16)33(31-21)20-9-8-18(27)14-19(20)28/h4-9,14,30H,3,10-13H2,1-2H3,(H2,29,35) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383403
(CHEMBL2030756)Show SMILES CC(=O)N1CCC(CC1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C24H23Cl3N4O2/c1-14-22(24(33)28-19-9-11-30(12-10-19)15(2)32)29-31(21-8-7-18(26)13-20(21)27)23(14)16-3-5-17(25)6-4-16/h3-8,13,19H,9-12H2,1-2H3,(H,28,33) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383396
(CHEMBL2030748)Show SMILES CCCCCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C35H38Cl3N5O2/c1-3-4-5-9-20-39-34(45)40-35(26-10-7-6-8-11-26)18-21-42(22-19-35)33(44)31-24(2)32(25-12-14-27(36)15-13-25)43(41-31)30-17-16-28(37)23-29(30)38/h6-8,10-17,23H,3-5,9,18-22H2,1-2H3,(H2,39,40,45) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383417
(CHEMBL2030939)Show SMILES CCOC(=O)N1CCC[C@H](C1)NC(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C25H25Cl3N4O3/c1-3-35-25(34)31-12-4-5-19(14-31)29-24(33)22-15(2)23(16-6-8-17(26)9-7-16)32(30-22)21-11-10-18(27)13-20(21)28/h6-11,13,19H,3-5,12,14H2,1-2H3,(H,29,33)/t19-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383402
(CHEMBL2030754)Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NC1CCN(CC1)C(=O)OC(C)(C)C Show InChI InChI=1S/C27H29Cl3N4O3/c1-16-23(25(35)31-20-11-13-33(14-12-20)26(36)37-27(2,3)4)32-34(22-10-9-19(29)15-21(22)30)24(16)17-5-7-18(28)8-6-17/h5-10,15,20H,11-14H2,1-4H3,(H,31,35) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50383401
(CHEMBL2030753)Show SMILES CCCCNC(=O)NC1(CCN(CC1)C(=O)c1nn(c(c1C)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)c1ccccc1 Show InChI InChI=1S/C33H34Cl3N5O2/c1-3-4-18-37-32(43)38-33(24-8-6-5-7-9-24)16-19-40(20-17-33)31(42)29-22(2)30(23-10-12-25(34)13-11-23)41(39-29)28-15-14-26(35)21-27(28)36/h5-15,21H,3-4,16-20H2,1-2H3,(H2,37,38,43) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Research Triangle Institute
Curated by ChEMBL
| Assay Description Displacement of [3H]CP55940 from CB2 receptor expressed in CHO-K1 cells |
J Med Chem 55: 2820-34 (2012)
Article DOI: 10.1021/jm201731z BindingDB Entry DOI: 10.7270/Q2P2704Z |
More data for this Ligand-Target Pair | |