BindingDB logo
myBDB logout

BDBM50193280 CHEMBL3895744

SMILES: Clc1ccc(c(Cl)c1)-n1nc(C(=O)CC2CCCCC2)c2CCCc3cc(Cl)ccc3-c12

InChI Key: InChIKey=MKSCKLPKMOVTIM-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50193280   
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 1


(Mus musculus (Mouse))
BDBM50193280
PNG
(CHEMBL3895744)
Show SMILES Clc1ccc(c(Cl)c1)-n1nc(C(=O)CC2CCCCC2)c2CCCc3cc(Cl)ccc3-c12
Show InChI InChI=1S/C26H25Cl3N2O/c27-18-9-11-20-17(14-18)7-4-8-21-25(24(32)13-16-5-2-1-3-6-16)30-31(26(20)21)23-12-10-19(28)15-22(23)29/h9-12,14-16H,1-8,13H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
8.5n/an/an/an/an/an/an/an/a



Neuroscienze PharmaNess S.c.a r.l.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from CB1 receptor in mouse whole brain membranes after 60 mins by liquid scintillation spectrometry


Eur J Med Chem 121: 194-208 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.011
BindingDB Entry DOI: 10.7270/Q2PR7XXB
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50193280
PNG
(CHEMBL3895744)
Show SMILES Clc1ccc(c(Cl)c1)-n1nc(C(=O)CC2CCCCC2)c2CCCc3cc(Cl)ccc3-c12
Show InChI InChI=1S/C26H25Cl3N2O/c27-18-9-11-20-17(14-18)7-4-8-21-25(24(32)13-16-5-2-1-3-6-16)30-31(26(20)21)23-12-10-19(28)15-22(23)29/h9-12,14-16H,1-8,13H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
325n/an/an/an/an/an/an/an/a



Neuroscienze PharmaNess S.c.a r.l.

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55,940 from human CB2 receptor transfected in CHO cell membranes after 60 mins by liquid scintillation spectrometry


Eur J Med Chem 121: 194-208 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.011
BindingDB Entry DOI: 10.7270/Q2PR7XXB
More data for this
Ligand-Target Pair