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BDBM50023685 CHEMBL3341895

SMILES: O=C(Nc1cccc(c1)-c1cccc(n1)N1CCCC1)Nc1cccc2ccccc12

InChI Key: InChIKey=NHAAXFJNCOPWPB-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50023685   
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


(Homo sapiens (Human))
BDBM50023685
PNG
(CHEMBL3341895)
Show SMILES O=C(Nc1cccc(c1)-c1cccc(n1)N1CCCC1)Nc1cccc2ccccc12
Show InChI InChI=1S/C26H24N4O/c31-26(29-24-14-6-9-19-8-1-2-12-22(19)24)27-21-11-5-10-20(18-21)23-13-7-15-25(28-23)30-16-3-4-17-30/h1-2,5-15,18H,3-4,16-17H2,(H2,27,29,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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



Research Triangle Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human CB1 receptor stably expressed in RD-HGA16 cells assessed as inhibition of CP55,940-induced calcium mobilization after 15...


J Med Chem 57: 7758-69 (2014)


Article DOI: 10.1021/jm501042u
BindingDB Entry DOI: 10.7270/Q26W9CNX
More data for this
Ligand-Target Pair