Reaction Details Report a problem with these data
Target
GTP-binding nuclear protein GSP1/CNR1
Ligand
BDBM87015
Substrate
n/a
Ki
100±n/a nM
Comments
PDSP_8600
Citation
 Wang, H; Duffy, RA; Boykow, GC; Chackalamannil, S; Madison, VS Identification of novel cannabinoid CB1 receptor antagonists by using virtual screening with a pharmacophore model. J Med Chem 51:2439-46 (2008) [PubMed]  Article 
Target
Name:
GTP-binding nuclear protein GSP1/CNR1
Synonyms:
CANNABINOID CB1 | CNR1 | CST17 | GSP1 | GSP1_YEAST | GTP-binding nuclear protein GSP1/CNR1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
24810.06
Organism:
Saccharomyces cerevisiae
Description:
CANNABINOID CB1 CNR1 0::P32835
Residue:
219
Sequence:
MSAPAANGEVPTFKLVLVGDGGTGKTTFVKRHLTGEFEKKYIATIGVEVHPLSFYTNFGEIKFDVWDTAGQEKFGGLRDGYYINAQCAIIMFDVTSRITYKNVPNWHRDLVRVCENIPIVLCGNKVDVKERKVKAKTITFHRKKNLQYYDISAKSNYNFEKPFLWLARKLAGNPQLEFVASPALAPPEVQVDEQLMQQYQQEMEQATALPLPDEDDADL
  
Inhibitor
Name:
BDBM87015
Synonyms:
1-(bis(4-chlorophenyl)methyl)-3-((3,5-difluorophenyl)(methylsulfonyl)methylene)azetidine | CAS_9810861 | NSC_9810861
Type:
Small organic molecule
Emp. Form.:
C24H19Cl2F2NO2S
Mol. Mass.:
494.381
SMILES:
[#6]S(=O)(=O)[#6](=[#6]-1/[#6]-[#7](-[#6]-1)-[#6](-c1ccc(Cl)cc1)-c1ccc(Cl)cc1)\c1cc(F)cc(F)c1
Structure:
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