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BDBM50202529 CHEMBL3965599

SMILES: CC(NC(=O)c1cc(C)n(c1C)-c1ccccc1)c1ccccc1

InChI Key: InChIKey=YZQXPJFHKGVZHE-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 = 50202529   
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))
BDBM50202529
PNG
(CHEMBL3965599)
Show SMILES CC(NC(=O)c1cc(C)n(c1C)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H22N2O/c1-15-14-20(17(3)23(15)19-12-8-5-9-13-19)21(24)22-16(2)18-10-6-4-7-11-18/h4-14,16H,1-3H3,(H,22,24)
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KEGG

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PC sid
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Similars

Article
PubMed
546n/an/an/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB2 receptor expressed in HEK293 cell membranes after 90 mins by radioligand binding assay


Eur J Med Chem 122: 619-634 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.012
BindingDB Entry DOI: 10.7270/Q2057HX9
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50202529
PNG
(CHEMBL3965599)
Show SMILES CC(NC(=O)c1cc(C)n(c1C)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H22N2O/c1-15-14-20(17(3)23(15)19-12-8-5-9-13-19)21(24)22-16(2)18-10-6-4-7-11-18/h4-14,16H,1-3H3,(H,22,24)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.62E+3n/an/an/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human CB1 receptor expressed in HEK293 cell membranes after 90 mins by radioligand binding assay


Eur J Med Chem 122: 619-634 (2016)


Article DOI: 10.1016/j.ejmech.2016.07.012
BindingDB Entry DOI: 10.7270/Q2057HX9
More data for this
Ligand-Target Pair