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BDBM50392708 CHEMBL2151377

SMILES: Cc1cc(ccc1Cl)C1=NN(CC1Cc1ccccc1)C(=O)NC1C(C)(C)C2CCC1(C)C2

InChI Key: InChIKey=MQHICJVDYIXPEL-UHFFFAOYSA-N

Data: 2 KI  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50392708   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50392708
PNG
(CHEMBL2151377)
Show SMILES Cc1cc(ccc1Cl)C1=NN(CC1Cc1ccccc1)C(=O)NC1C(C)(C)C2CCC1(C)C2 |t:9|
Show InChI InChI=1S/C28H34ClN3O/c1-18-14-20(10-11-23(18)29)24-21(15-19-8-6-5-7-9-19)17-32(31-24)26(33)30-25-27(2,3)22-12-13-28(25,4)16-22/h5-11,14,21-22,25H,12-13,15-17H2,1-4H3,(H,30,33)
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PC cid
PC sid
UniChem
Article
PubMed
689n/an/an/an/an/an/an/an/a



Avenue de l'Universit£

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cell membranes after 1 hr by scintillation counting


Eur J Med Chem 58: 396-404 (2012)


Article DOI: 10.1016/j.ejmech.2012.10.031
BindingDB Entry DOI: 10.7270/Q2474BZG
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50392708
PNG
(CHEMBL2151377)
Show SMILES Cc1cc(ccc1Cl)C1=NN(CC1Cc1ccccc1)C(=O)NC1C(C)(C)C2CCC1(C)C2 |t:9|
Show InChI InChI=1S/C28H34ClN3O/c1-18-14-20(10-11-23(18)29)24-21(15-19-8-6-5-7-9-19)17-32(31-24)26(33)30-25-27(2,3)22-12-13-28(25,4)16-22/h5-11,14,21-22,25H,12-13,15-17H2,1-4H3,(H,30,33)
PDB

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PC cid
PC sid
UniChem
Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Avenue de l'Universit£

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in CHO cell membranes after 1 hr by scintillation counting


Eur J Med Chem 58: 396-404 (2012)


Article DOI: 10.1016/j.ejmech.2012.10.031
BindingDB Entry DOI: 10.7270/Q2474BZG
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50392708
PNG
(CHEMBL2151377)
Show SMILES Cc1cc(ccc1Cl)C1=NN(CC1Cc1ccccc1)C(=O)NC1C(C)(C)C2CCC1(C)C2 |t:9|
Show InChI InChI=1S/C28H34ClN3O/c1-18-14-20(10-11-23(18)29)24-21(15-19-8-6-5-7-9-19)17-32(31-24)26(33)30-25-27(2,3)22-12-13-28(25,4)16-22/h5-11,14,21-22,25H,12-13,15-17H2,1-4H3,(H,30,33)
PDB

Reactome pathway
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UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 749n/an/an/an/a



Avenue de l'Universit£

Curated by ChEMBL


Assay Description
Agonist activity at human CB2 receptor expressed in CHO cell membranes after 1 hr by [35S]GTPgammaS binding assay


Eur J Med Chem 58: 396-404 (2012)


Article DOI: 10.1016/j.ejmech.2012.10.031
BindingDB Entry DOI: 10.7270/Q2474BZG
More data for this
Ligand-Target Pair