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BDBM50192610 CHEMBL384897::JWH-372::naphthalen-1-yl(1-pentyl-5-(2-(trifluoromethyl)phenyl)-1H-pyrrol-3-yl)methanone

SMILES: CCCCCn1cc(cc1-c1ccccc1C(F)(F)F)C(=O)c1cccc2ccccc12

InChI Key: InChIKey=CYPUIQJYGVOHMM-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50192610   
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))
BDBM50192610
PNG
(CHEMBL384897 | JWH-372 | naphthalen-1-yl(1-pentyl-...)
Show SMILES CCCCCn1cc(cc1-c1ccccc1C(F)(F)F)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C27H24F3NO/c1-2-3-8-16-31-18-20(17-25(31)23-13-6-7-15-24(23)27(28,29)30)26(32)22-14-9-11-19-10-4-5-12-21(19)22/h4-7,9-15,17-18H,2-3,8,16H2,1H3
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PC cid
PC sid
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Similars

Article
PubMed
8.20n/an/an/an/an/an/an/an/a



Clemson University

Curated by ChEMBL


Assay Description
Displacement of [3H]CP 55940 from human cloned CB2 receptor


Bioorg Med Chem Lett 16: 5432-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.051
BindingDB Entry DOI: 10.7270/Q2610ZXH
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50192610
PNG
(CHEMBL384897 | JWH-372 | naphthalen-1-yl(1-pentyl-...)
Show SMILES CCCCCn1cc(cc1-c1ccccc1C(F)(F)F)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C27H24F3NO/c1-2-3-8-16-31-18-20(17-25(31)23-13-6-7-15-24(23)27(28,29)30)26(32)22-14-9-11-19-10-4-5-12-21(19)22/h4-7,9-15,17-18H,2-3,8,16H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
77n/an/an/an/an/an/an/an/a



Clemson University

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 5432-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.051
BindingDB Entry DOI: 10.7270/Q2610ZXH
More data for this
Ligand-Target Pair