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BDBM50170336 2-(3-Fluoro-phenyl)-1-(2-methyl-1-pentyl-1H-indol-3-yl)-ethanone::2-(3-fluorophenyl)-1-(2-methyl-1-pentyl-1H-indol-3-yl)ethanone::CHEMBL427524::JWH-315

SMILES: CCCCCn1c(C)c(C(=O)Cc2cccc(F)c2)c2ccccc12

InChI Key: InChIKey=STCKLQNFQVHGSM-UHFFFAOYSA-N

Data: 4 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50170336   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50170336
PNG
(2-(3-Fluoro-phenyl)-1-(2-methyl-1-pentyl-1H-indol-...)
Show SMILES CCCCCn1c(C)c(C(=O)Cc2cccc(F)c2)c2ccccc12
Show InChI InChI=1S/C22H24FNO/c1-3-4-7-13-24-16(2)22(19-11-5-6-12-20(19)24)21(25)15-17-9-8-10-18(23)14-17/h5-6,8-12,14H,3-4,7,13,15H2,1-2H3
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Article
PubMed
182n/an/an/an/an/an/an/an/a



Clemson University

Curated by ChEMBL


Assay Description
Binding affinity to displace [3H]CP-55,940 from cloned human CB2 receptor


Bioorg Med Chem Lett 15: 4110-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.008
BindingDB Entry DOI: 10.7270/Q2KD1XGV
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50170336
PNG
(2-(3-Fluoro-phenyl)-1-(2-methyl-1-pentyl-1H-indol-...)
Show SMILES CCCCCn1c(C)c(C(=O)Cc2cccc(F)c2)c2ccccc12
Show InChI InChI=1S/C22H24FNO/c1-3-4-7-13-24-16(2)22(19-11-5-6-12-20(19)24)21(25)15-17-9-8-10-18(23)14-17/h5-6,8-12,14H,3-4,7,13,15H2,1-2H3
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182n/an/an/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human cloned CB2 receptor by filtration assay


Eur J Med Chem 44: 2482-96 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.026
BindingDB Entry DOI: 10.7270/Q2K64K9J
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50170336
PNG
(2-(3-Fluoro-phenyl)-1-(2-methyl-1-pentyl-1H-indol-...)
Show SMILES CCCCCn1c(C)c(C(=O)Cc2cccc(F)c2)c2ccccc12
Show InChI InChI=1S/C22H24FNO/c1-3-4-7-13-24-16(2)22(19-11-5-6-12-20(19)24)21(25)15-17-9-8-10-18(23)14-17/h5-6,8-12,14H,3-4,7,13,15H2,1-2H3
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430n/an/an/an/an/an/an/an/a



Clemson University

Curated by ChEMBL


Assay Description
Binding affinity to displace [3H]CP-55,940 from CB1 receptor of rat brain


Bioorg Med Chem Lett 15: 4110-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.008
BindingDB Entry DOI: 10.7270/Q2KD1XGV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50170336
PNG
(2-(3-Fluoro-phenyl)-1-(2-methyl-1-pentyl-1H-indol-...)
Show SMILES CCCCCn1c(C)c(C(=O)Cc2cccc(F)c2)c2ccccc12
Show InChI InChI=1S/C22H24FNO/c1-3-4-7-13-24-16(2)22(19-11-5-6-12-20(19)24)21(25)15-17-9-8-10-18(23)14-17/h5-6,8-12,14H,3-4,7,13,15H2,1-2H3
PDB

Reactome pathway
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PC sid
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Article
PubMed
431n/an/an/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from CB1 receptor in rat brain by filtration assay


Eur J Med Chem 44: 2482-96 (2009)


Article DOI: 10.1016/j.ejmech.2009.01.026
BindingDB Entry DOI: 10.7270/Q2K64K9J
More data for this
Ligand-Target Pair