BindingDB logo
myBDB logout

PubMed code 23434135

Compile data set for download or QSAR
Found 27 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM21281
PNG
((11R)-2-methyl-11-(morpholin-4-ylmethyl)-3-(naphth...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@@H](CN4CCOCC4)n1c23 |r|
Show InChI InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
3.70n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM21278
PNG
(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
KEGG
PC cid
PC sid
UniChem

Patents

DrugBank
Article
PubMed
7.30n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM21281
PNG
((11R)-2-methyl-11-(morpholin-4-ylmethyl)-3-(naphth...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2cccc3OC[C@@H](CN4CCOCC4)n1c23 |r|
Show InChI InChI=1S/C27H26N2O3/c1-18-25(27(30)22-9-4-7-19-6-2-3-8-21(19)22)23-10-5-11-24-26(23)29(18)20(17-32-24)16-28-12-14-31-15-13-28/h2-11,20H,12-17H2,1H3/t20-/m1/s1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
46n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431807
PNG
(CHEMBL2347041)
Show SMILES CCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H19Cl3N2/c1-2-3-4-5-17-13-20(14-6-8-15(21)9-7-14)25(24-17)19-11-10-16(22)12-18(19)23/h6-13H,2-5H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
458n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50147009
PNG
(5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-3-hexy...)
Show SMILES CCCCCCc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H20Cl3N3/c1-2-3-4-5-6-19-24-20(14-7-9-15(21)10-8-14)26(25-19)18-12-11-16(22)13-17(18)23/h7-13H,2-6H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
829n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431808
PNG
(CHEMBL2347040)
Show SMILES CCCCCc1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C20H22N2/c1-2-3-6-13-18-16-20(17-11-7-4-8-12-17)22(21-18)19-14-9-5-10-15-19/h4-5,7-12,14-16H,2-3,6,13H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.94E+3n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50147009
PNG
(5-(4-Chloro-phenyl)-1-(2,4-dichloro-phenyl)-3-hexy...)
Show SMILES CCCCCCc1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H20Cl3N3/c1-2-3-4-5-6-19-24-20(14-7-9-15(21)10-8-14)26(25-19)18-12-11-16(22)13-17(18)23/h7-13H,2-6H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
3.08E+3n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431803
PNG
(CHEMBL2347045)
Show SMILES O=C(NN1CCCCC1)c1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C21H22N4O/c26-21(23-24-14-8-3-9-15-24)19-16-20(17-10-4-1-5-11-17)25(22-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,23,26)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
4.59E+3n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431808
PNG
(CHEMBL2347040)
Show SMILES CCCCCc1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C20H22N2/c1-2-3-6-13-18-16-20(17-11-7-4-8-12-17)22(21-18)19-14-9-5-10-15-19/h4-5,7-12,14-16H,2-3,6,13H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
6.16E+3n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431800
PNG
(CHEMBL2347048)
Show SMILES Cc1c(nn(c1-c1ccccc1)-c1ccccc1)C(=O)NN1CCCCC1
Show InChI InChI=1S/C22H24N4O/c1-17-20(22(27)24-25-15-9-4-10-16-25)23-26(19-13-7-3-8-14-19)21(17)18-11-5-2-6-12-18/h2-3,5-8,11-14H,4,9-10,15-16H2,1H3,(H,24,27)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
9.69E+3n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431798
PNG
(CHEMBL2347050)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C31H42Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-34-31(38)29-35-30(25-16-18-26(32)19-17-25)37(36-29)28-22-20-27(33)21-23-28/h16-23H,2-15,24H2,1H3,(H,34,38)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431801
PNG
(CHEMBL2347047)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C33H47N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-34-33(37)31-28(2)32(29-23-18-16-19-24-29)36(35-31)30-25-20-17-21-26-30/h16-21,23-26H,3-15,22,27H2,1-2H3,(H,34,37)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431798
PNG
(CHEMBL2347050)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C31H42Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-34-31(38)29-35-30(25-16-18-26(32)19-17-25)37(36-29)28-22-20-27(33)21-23-28/h16-23H,2-15,24H2,1H3,(H,34,38)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431801
PNG
(CHEMBL2347047)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C33H47N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-27-34-33(37)31-28(2)32(29-23-18-16-19-24-29)36(35-31)30-25-20-17-21-26-30/h16-21,23-26H,3-15,22,27H2,1-2H3,(H,34,37)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431804
PNG
(CHEMBL2347044)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C32H45N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-26-33-32(36)30-27-31(28-22-17-15-18-23-28)35(34-30)29-24-19-16-20-25-29/h15-20,22-25,27H,2-14,21,26H2,1H3,(H,33,36)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431800
PNG
(CHEMBL2347048)
Show SMILES Cc1c(nn(c1-c1ccccc1)-c1ccccc1)C(=O)NN1CCCCC1
Show InChI InChI=1S/C22H24N4O/c1-17-20(22(27)24-25-15-9-4-10-16-25)23-26(19-13-7-3-8-14-19)21(17)18-11-5-2-6-12-18/h2-3,5-8,11-14H,4,9-10,15-16H2,1H3,(H,24,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.82E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431803
PNG
(CHEMBL2347045)
Show SMILES O=C(NN1CCCCC1)c1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C21H22N4O/c26-21(23-24-14-8-3-9-15-24)19-16-20(17-10-4-1-5-11-17)25(22-19)18-12-6-2-7-13-18/h1-2,4-7,10-13,16H,3,8-9,14-15H2,(H,23,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.79E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431802
PNG
(CHEMBL2347046)
Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C35H49N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-29-36-35(39)33-30(2)34(31-25-20-18-21-26-31)38(37-33)32-27-22-19-23-28-32/h10-11,18-23,25-28H,3-9,12-17,24,29H2,1-2H3,(H,36,39)/b11-10-
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431799
PNG
(CHEMBL2347049)
Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C33H44Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-36-33(40)31-37-32(27-18-20-28(34)21-19-27)39(38-31)30-24-22-29(35)23-25-30/h9-10,18-25H,2-8,11-17,26H2,1H3,(H,36,40)/b10-9-
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431806
PNG
(CHEMBL2347042)
Show SMILES CCCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H21Cl3N2/c1-2-3-4-5-6-18-14-21(15-7-9-16(22)10-8-15)26(25-18)20-12-11-17(23)13-19(20)24/h7-14H,2-6H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431799
PNG
(CHEMBL2347049)
Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C33H44Cl2N4O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-26-36-33(40)31-37-32(27-18-20-28(34)21-19-27)39(38-31)30-24-22-29(35)23-25-30/h9-10,18-25H,2-8,11-17,26H2,1H3,(H,36,40)/b10-9-
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431807
PNG
(CHEMBL2347041)
Show SMILES CCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H19Cl3N2/c1-2-3-4-5-17-13-20(14-6-8-15(21)9-7-14)25(24-17)19-11-10-16(22)12-18(19)23/h6-13H,2-5H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431802
PNG
(CHEMBL2347046)
Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1nn(c(c1C)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C35H49N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-29-36-35(39)33-30(2)34(31-25-20-18-21-26-31)38(37-33)32-27-22-19-23-28-32/h10-11,18-23,25-28H,3-9,12-17,24,29H2,1-2H3,(H,36,39)/b11-10-
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431806
PNG
(CHEMBL2347042)
Show SMILES CCCCCCc1cc(-c2ccc(Cl)cc2)n(n1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C21H21Cl3N2/c1-2-3-4-5-6-18-14-21(15-7-9-16(22)10-8-15)26(25-18)20-12-11-17(23)13-19(20)24/h7-14H,2-6H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431805
PNG
(CHEMBL2347043)
Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C34H47N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-28-35-34(38)32-29-33(30-24-19-17-20-25-30)37(36-32)31-26-21-18-22-27-31/h9-10,17-22,24-27,29H,2-8,11-16,23,28H2,1H3,(H,35,38)/b10-9-
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50431804
PNG
(CHEMBL2347044)
Show SMILES CCCCCCCCCCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C32H45N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-26-33-32(36)30-27-31(28-22-17-15-18-23-28)35(34-30)29-24-19-16-20-25-29/h15-20,22-25,27H,2-14,21,26H2,1H3,(H,33,36)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB1 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50431805
PNG
(CHEMBL2347043)
Show SMILES CCCCCCCC\C=C/CCCCCCCCNC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1
Show InChI InChI=1S/C34H47N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-28-35-34(38)32-29-33(30-24-19-17-20-25-30)37(36-32)31-26-21-18-22-27-31/h9-10,17-22,24-27,29H,2-8,11-16,23,28H2,1H3,(H,35,38)/b10-9-
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor after 90 mins by liquid scintillation spectrophotometer analysis


Bioorg Med Chem 21: 1708-16 (2013)


Article DOI: 10.1016/j.bmc.2013.01.055
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%