Found 46 hits Enz. Inhib. hit(s) with all data for entry = 50044062 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005282
(CHEMBL3114534)Show SMILES OC(c1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)n2ccccc12)c1cccnc1 |TLB:7:8:11:15.13.14,THB:13:12:9:15.14.16,13:14:11.12.17:9,16:14:11:17.8.9,16:8:11:15.13.14| Show InChI InChI=1S/C24H26N4O2/c29-21(18-4-3-6-25-14-18)20-19-5-1-2-7-28(19)22(26-20)23(30)27-24-11-15-8-16(12-24)10-17(9-15)13-24/h1-7,14-17,21,29H,8-13H2,(H,27,30) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005282
(CHEMBL3114534)Show SMILES OC(c1nc(C(=O)NC23CC4CC(CC(C4)C2)C3)n2ccccc12)c1cccnc1 |TLB:7:8:11:15.13.14,THB:13:12:9:15.14.16,13:14:11.12.17:9,16:14:11:17.8.9,16:8:11:15.13.14| Show InChI InChI=1S/C24H26N4O2/c29-21(18-4-3-6-25-14-18)20-19-5-1-2-7-28(19)22(26-20)23(30)27-24-11-15-8-16(12-24)10-17(9-15)13-24/h1-7,14-17,21,29H,8-13H2,(H,27,30) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005271
(CHEMBL3114523)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1cncnc1 Show InChI InChI=1S/C21H19N5O/c1-2-26-18-10-6-9-17(16-7-4-3-5-8-16)19(18)25-20(26)21(27)24-13-15-11-22-14-23-12-15/h3-12,14H,2,13H2,1H3,(H,24,27) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005272
(CHEMBL3114522)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1ccc(cc1)C#N Show InChI InChI=1S/C24H20N4O/c1-2-28-21-10-6-9-20(19-7-4-3-5-8-19)22(21)27-23(28)24(29)26-16-18-13-11-17(15-25)12-14-18/h3-14H,2,16H2,1H3,(H,26,29) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005273
(CHEMBL3114521)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1ccccc1F Show InChI InChI=1S/C23H20FN3O/c1-2-27-20-14-8-12-18(16-9-4-3-5-10-16)21(20)26-22(27)23(28)25-15-17-11-6-7-13-19(17)24/h3-14H,2,15H2,1H3,(H,25,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005274
(CHEMBL3114520)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1cccc(Cl)c1 Show InChI InChI=1S/C23H20ClN3O/c1-2-27-20-13-7-12-19(17-9-4-3-5-10-17)21(20)26-22(27)23(28)25-15-16-8-6-11-18(24)14-16/h3-14H,2,15H2,1H3,(H,25,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005275
(CHEMBL3114519)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1ccccc1Cl Show InChI InChI=1S/C23H20ClN3O/c1-2-27-20-14-8-12-18(16-9-4-3-5-10-16)21(20)26-22(27)23(28)25-15-17-11-6-7-13-19(17)24/h3-14H,2,15H2,1H3,(H,25,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 913 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005276
(CHEMBL3114518)Show SMILES Fc1cccnc1CNC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C20H15FN4O/c21-15-9-5-11-22-17(15)12-23-20(26)19-24-16-10-4-8-14(18(16)25-19)13-6-2-1-3-7-13/h1-11H,12H2,(H,23,26)(H,24,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005277
(CHEMBL3114517)Show InChI InChI=1S/C21H17N3O/c25-21(22-14-15-8-3-1-4-9-15)20-23-18-13-7-12-17(19(18)24-20)16-10-5-2-6-11-16/h1-13H,14H2,(H,22,25)(H,23,24) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005278
(CHEMBL3114516)Show SMILES Clc1ccccc1CNC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C21H16ClN3O/c22-17-11-5-4-9-15(17)13-23-21(26)20-24-18-12-6-10-16(19(18)25-20)14-7-2-1-3-8-14/h1-12H,13H2,(H,23,26)(H,24,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005279
(CHEMBL3114515)Show SMILES FC(F)(F)c1cccc(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)c1 Show InChI InChI=1S/C22H16F3N3O/c23-22(24,25)16-9-4-6-14(12-16)13-26-21(29)20-27-18-11-5-10-17(19(18)28-20)15-7-2-1-3-8-15/h1-12H,13H2,(H,26,29)(H,27,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005280
(CHEMBL3114514)Show SMILES Fc1ccccc1CNC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C21H16FN3O/c22-17-11-5-4-9-15(17)13-23-21(26)20-24-18-12-6-10-16(19(18)25-20)14-7-2-1-3-8-14/h1-12H,13H2,(H,23,26)(H,24,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005281
(CHEMBL3114513)Show SMILES Clc1cccc(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)c1 Show InChI InChI=1S/C21H16ClN3O/c22-16-9-4-6-14(12-16)13-23-21(26)20-24-18-11-5-10-17(19(18)25-20)15-7-2-1-3-8-15/h1-12H,13H2,(H,23,26)(H,24,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005283
(CHEMBL3114533)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3n2CC(F)(F)F)-c2ccccc2)CCCC1 Show InChI InChI=1S/C23H24F3N3O2/c24-23(25,26)14-29-18-10-6-9-17(16-7-2-1-3-8-16)19(18)28-20(29)21(31)27-13-22(15-30)11-4-5-12-22/h1-3,6-10,30H,4-5,11-15H2,(H,27,31) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005284
(CHEMBL3114532)Show SMILES CC(C)(C)CNC(=O)c1nc2c(cccc2n1CC(F)(F)F)-c1ccccc1 Show InChI InChI=1S/C21H22F3N3O/c1-20(2,3)12-25-19(28)18-26-17-15(14-8-5-4-6-9-14)10-7-11-16(17)27(18)13-21(22,23)24/h4-11H,12-13H2,1-3H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005285
(CHEMBL3114531)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3n2CC(F)(F)F)-c2ccccc2)CCCCC1 Show InChI InChI=1S/C24H26F3N3O2/c25-24(26,27)15-30-19-11-7-10-18(17-8-3-1-4-9-17)20(19)29-21(30)22(32)28-14-23(16-31)12-5-2-6-13-23/h1,3-4,7-11,31H,2,5-6,12-16H2,(H,28,32) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.97E+3 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005286
(CHEMBL3112609)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCC1(CO)CCCC1 Show InChI InChI=1S/C23H27N3O2/c1-2-26-19-12-8-11-18(17-9-4-3-5-10-17)20(19)25-21(26)22(28)24-15-23(16-27)13-6-7-14-23/h3-5,8-12,27H,2,6-7,13-16H2,1H3,(H,24,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.26E+3 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005287
(CHEMBL3114530)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCC(C)(C)C Show InChI InChI=1S/C21H25N3O/c1-5-24-17-13-9-12-16(15-10-7-6-8-11-15)18(17)23-19(24)20(25)22-14-21(2,3)4/h6-13H,5,14H2,1-4H3,(H,22,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 490 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005288
(CHEMBL3114529)Show SMILES OCC1(CCCCC1)NC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C21H23N3O2/c25-14-21(12-5-2-6-13-21)24-20(26)19-22-17-11-7-10-16(18(17)23-19)15-8-3-1-4-9-15/h1,3-4,7-11,25H,2,5-6,12-14H2,(H,22,23)(H,24,26) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 236 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005289
(CHEMBL3114528)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)CCCCC1 Show InChI InChI=1S/C22H25N3O2/c26-15-22(12-5-2-6-13-22)14-23-21(27)20-24-18-11-7-10-17(19(18)25-20)16-8-3-1-4-9-16/h1,3-4,7-11,26H,2,5-6,12-15H2,(H,23,27)(H,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 43 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005290
(CHEMBL3114527)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)CCCC1 Show InChI InChI=1S/C21H23N3O2/c25-14-21(11-4-5-12-21)13-22-20(26)19-23-17-10-6-9-16(18(17)24-19)15-7-2-1-3-8-15/h1-3,6-10,25H,4-5,11-14H2,(H,22,26)(H,23,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 25 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005291
(CHEMBL3114526)Show InChI InChI=1S/C19H21N3O/c1-19(2,3)12-20-18(23)17-21-15-11-7-10-14(16(15)22-17)13-8-5-4-6-9-13/h4-11H,12H2,1-3H3,(H,20,23)(H,21,22) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 15 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005220
(CHEMBL3114525)Show InChI InChI=1S/C17H17N3O3/c21-10-12(22)9-18-17(23)16-19-14-8-4-7-13(15(14)20-16)11-5-2-1-3-6-11/h1-8,12,21-22H,9-10H2,(H,18,23)(H,19,20) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 6.30 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005241
(CHEMBL3114524)Show SMILES O=C(NC12CC3CC(CC(C3)C1)C2)c1nc2c(cccc2[nH]1)-c1ccccc1 |TLB:2:3:6:10.8.9,THB:8:7:4:10.9.11,8:9:6.7.12:4,11:9:6:12.3.4,11:3:6:10.8.9| Show InChI InChI=1S/C24H25N3O/c28-23(27-24-12-15-9-16(13-24)11-17(10-15)14-24)22-25-20-8-4-7-19(21(20)26-22)18-5-2-1-3-6-18/h1-8,15-17H,9-14H2,(H,25,26)(H,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005271
(CHEMBL3114523)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1cncnc1 Show InChI InChI=1S/C21H19N5O/c1-2-26-18-10-6-9-17(16-7-4-3-5-8-16)19(18)25-20(26)21(27)24-13-15-11-22-14-23-12-15/h3-12,14H,2,13H2,1H3,(H,24,27) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005272
(CHEMBL3114522)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1ccc(cc1)C#N Show InChI InChI=1S/C24H20N4O/c1-2-28-21-10-6-9-20(19-7-4-3-5-8-19)22(21)27-23(28)24(29)26-16-18-13-11-17(15-25)12-14-18/h3-14H,2,16H2,1H3,(H,26,29) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 84 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005273
(CHEMBL3114521)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1ccccc1F Show InChI InChI=1S/C23H20FN3O/c1-2-27-20-14-8-12-18(16-9-4-3-5-10-16)21(20)26-22(27)23(28)25-15-17-11-6-7-13-19(17)24/h3-14H,2,15H2,1H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 45 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005274
(CHEMBL3114520)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1cccc(Cl)c1 Show InChI InChI=1S/C23H20ClN3O/c1-2-27-20-13-7-12-19(17-9-4-3-5-10-17)21(20)26-22(27)23(28)25-15-16-8-6-11-18(24)14-16/h3-14H,2,15H2,1H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 40 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005275
(CHEMBL3114519)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCc1ccccc1Cl Show InChI InChI=1S/C23H20ClN3O/c1-2-27-20-14-8-12-18(16-9-4-3-5-10-16)21(20)26-22(27)23(28)25-15-17-11-6-7-13-19(17)24/h3-14H,2,15H2,1H3,(H,25,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 9.90 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005276
(CHEMBL3114518)Show SMILES Fc1cccnc1CNC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C20H15FN4O/c21-15-9-5-11-22-17(15)12-23-20(26)19-24-16-10-4-8-14(18(16)25-19)13-6-2-1-3-7-13/h1-11H,12H2,(H,23,26)(H,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.44E+3 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005277
(CHEMBL3114517)Show InChI InChI=1S/C21H17N3O/c25-21(22-14-15-8-3-1-4-9-15)20-23-18-13-7-12-17(19(18)24-20)16-10-5-2-6-11-16/h1-13H,14H2,(H,22,25)(H,23,24) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 991 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005278
(CHEMBL3114516)Show SMILES Clc1ccccc1CNC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C21H16ClN3O/c22-17-11-5-4-9-15(17)13-23-21(26)20-24-18-12-6-10-16(19(18)25-20)14-7-2-1-3-8-14/h1-12H,13H2,(H,23,26)(H,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 443 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005279
(CHEMBL3114515)Show SMILES FC(F)(F)c1cccc(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)c1 Show InChI InChI=1S/C22H16F3N3O/c23-22(24,25)16-9-4-6-14(12-16)13-26-21(29)20-27-18-11-5-10-17(19(18)28-20)15-7-2-1-3-8-15/h1-12H,13H2,(H,26,29)(H,27,28) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 256 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005280
(CHEMBL3114514)Show SMILES Fc1ccccc1CNC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C21H16FN3O/c22-17-11-5-4-9-15(17)13-23-21(26)20-24-18-12-6-10-16(19(18)25-20)14-7-2-1-3-8-14/h1-12H,13H2,(H,23,26)(H,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 256 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50005281
(CHEMBL3114513)Show SMILES Clc1cccc(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)c1 Show InChI InChI=1S/C21H16ClN3O/c22-16-9-4-6-14(12-16)13-23-21(26)20-24-18-11-5-10-17(19(18)25-20)15-7-2-1-3-8-15/h1-12H,13H2,(H,23,26)(H,24,25) | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 165 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB2 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005283
(CHEMBL3114533)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3n2CC(F)(F)F)-c2ccccc2)CCCC1 Show InChI InChI=1S/C23H24F3N3O2/c24-23(25,26)14-29-18-10-6-9-17(16-7-2-1-3-8-16)19(18)28-20(29)21(31)27-13-22(15-30)11-4-5-12-22/h1-3,6-10,30H,4-5,11-15H2,(H,27,31) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005284
(CHEMBL3114532)Show SMILES CC(C)(C)CNC(=O)c1nc2c(cccc2n1CC(F)(F)F)-c1ccccc1 Show InChI InChI=1S/C21H22F3N3O/c1-20(2,3)12-25-19(28)18-26-17-15(14-8-5-4-6-9-14)10-7-11-16(17)27(18)13-21(22,23)24/h4-11H,12-13H2,1-3H3,(H,25,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005285
(CHEMBL3114531)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3n2CC(F)(F)F)-c2ccccc2)CCCCC1 Show InChI InChI=1S/C24H26F3N3O2/c25-24(26,27)15-30-19-11-7-10-18(17-8-3-1-4-9-17)20(19)29-21(30)22(32)28-14-23(16-31)12-5-2-6-13-23/h1,3-4,7-11,31H,2,5-6,12-16H2,(H,28,32) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005286
(CHEMBL3112609)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCC1(CO)CCCC1 Show InChI InChI=1S/C23H27N3O2/c1-2-26-19-12-8-11-18(17-9-4-3-5-10-17)20(19)25-21(26)22(28)24-15-23(16-27)13-6-7-14-23/h3-5,8-12,27H,2,6-7,13-16H2,1H3,(H,24,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005287
(CHEMBL3114530)Show SMILES CCn1c(nc2c(cccc12)-c1ccccc1)C(=O)NCC(C)(C)C Show InChI InChI=1S/C21H25N3O/c1-5-24-17-13-9-12-16(15-10-7-6-8-11-15)18(17)23-19(24)20(25)22-14-21(2,3)4/h6-13H,5,14H2,1-4H3,(H,22,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 913 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005288
(CHEMBL3114529)Show SMILES OCC1(CCCCC1)NC(=O)c1nc2c(cccc2[nH]1)-c1ccccc1 Show InChI InChI=1S/C21H23N3O2/c25-14-21(12-5-2-6-13-21)24-20(26)19-22-17-11-7-10-16(18(17)23-19)15-8-3-1-4-9-15/h1,3-4,7-11,25H,2,5-6,12-14H2,(H,22,23)(H,24,26) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005289
(CHEMBL3114528)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)CCCCC1 Show InChI InChI=1S/C22H25N3O2/c26-15-22(12-5-2-6-13-22)14-23-21(27)20-24-18-11-7-10-17(19(18)25-20)16-8-3-1-4-9-16/h1,3-4,7-11,26H,2,5-6,12-15H2,(H,23,27)(H,24,25) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005290
(CHEMBL3114527)Show SMILES OCC1(CNC(=O)c2nc3c(cccc3[nH]2)-c2ccccc2)CCCC1 Show InChI InChI=1S/C21H23N3O2/c25-14-21(11-4-5-12-21)13-22-20(26)19-23-17-10-6-9-16(18(17)24-19)15-7-2-1-3-8-15/h1-3,6-10,25H,4-5,11-14H2,(H,22,26)(H,23,24) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005291
(CHEMBL3114526)Show InChI InChI=1S/C19H21N3O/c1-19(2,3)12-20-18(23)17-21-15-11-7-10-14(16(15)22-17)13-8-5-4-6-9-13/h4-11H,12H2,1-3H3,(H,20,23)(H,21,22) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005220
(CHEMBL3114525)Show InChI InChI=1S/C17H17N3O3/c21-10-12(22)9-18-17(23)16-19-14-8-4-7-13(15(14)20-16)11-5-2-1-3-6-11/h1-8,12,21-22H,9-10H2,(H,18,23)(H,19,20) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >1.70E+4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50005241
(CHEMBL3114524)Show SMILES O=C(NC12CC3CC(CC(C3)C1)C2)c1nc2c(cccc2[nH]1)-c1ccccc1 |TLB:2:3:6:10.8.9,THB:8:7:4:10.9.11,8:9:6.7.12:4,11:9:6:12.3.4,11:3:6:10.8.9| Show InChI InChI=1S/C24H25N3O/c28-23(27-24-12-15-9-16(13-24)11-17(10-15)14-24)22-25-20-8-4-7-19(21(20)26-22)18-5-2-1-3-6-18/h1-8,15-17H,9-14H2,(H,25,26)(H,27,28) | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 123 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human CB1 receptor expressed in CHO-K1 cells assessed as forskolin-induced cAMP accumulation after 1 hr |
Bioorg Med Chem Lett 24: 1218-21 (2014)
Article DOI: 10.1016/j.bmcl.2013.12.068
BindingDB Entry DOI: 10.7270/Q2FJ2J9K |
More data for this
Ligand-Target Pair | |
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