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BDBM50207249 CHEMBL3981255

SMILES: CCCc1nc2ccccc2n1C(=O)c1cccc2ccccc12

InChI Key: InChIKey=BEJODQWULIPCQD-UHFFFAOYSA-N

Data: 2 KI  2 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 4 hits for monomerid = 50207249   
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))
BDBM50207249
PNG
(CHEMBL3981255)
Show SMILES CCCc1nc2ccccc2n1C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H18N2O/c1-2-8-20-22-18-13-5-6-14-19(18)23(20)21(24)17-12-7-10-15-9-3-4-11-16(15)17/h3-7,9-14H,2,8H2,1H3
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pontificia Universidad Cat£lica de Chile

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes incubated for 1.5 hrs


Eur J Med Chem 124: 17-35 (2016)


Article DOI: 10.1016/j.ejmech.2016.08.005
BindingDB Entry DOI: 10.7270/Q2Q2426V
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50207249
PNG
(CHEMBL3981255)
Show SMILES CCCc1nc2ccccc2n1C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H18N2O/c1-2-8-20-22-18-13-5-6-14-19(18)23(20)21(24)17-12-7-10-15-9-3-4-11-16(15)17/h3-7,9-14H,2,8H2,1H3
PDB

Reactome pathway
KEGG

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UniProtKB/TrEMBL

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Pontificia Universidad Cat£lica de Chile

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes incubated for 1.5 hrs


Eur J Med Chem 124: 17-35 (2016)


Article DOI: 10.1016/j.ejmech.2016.08.005
BindingDB Entry DOI: 10.7270/Q2Q2426V
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50207249
PNG
(CHEMBL3981255)
Show SMILES CCCc1nc2ccccc2n1C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H18N2O/c1-2-8-20-22-18-13-5-6-14-19(18)23(20)21(24)17-12-7-10-15-9-3-4-11-16(15)17/h3-7,9-14H,2,8H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

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CHEMBL
PC cid
PC sid
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Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pontificia Universidad Cat£lica de Chile

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes incubated for 1.5 hrs


Eur J Med Chem 124: 17-35 (2016)


Article DOI: 10.1016/j.ejmech.2016.08.005
BindingDB Entry DOI: 10.7270/Q2Q2426V
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50207249
PNG
(CHEMBL3981255)
Show SMILES CCCc1nc2ccccc2n1C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H18N2O/c1-2-8-20-22-18-13-5-6-14-19(18)23(20)21(24)17-12-7-10-15-9-3-4-11-16(15)17/h3-7,9-14H,2,8H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pontificia Universidad Cat£lica de Chile

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes incubated for 1.5 hrs


Eur J Med Chem 124: 17-35 (2016)


Article DOI: 10.1016/j.ejmech.2016.08.005
BindingDB Entry DOI: 10.7270/Q2Q2426V
More data for this
Ligand-Target Pair