Reaction Details Report a problem with these data
Target
G-protein coupled receptor 55
Ligand
BDBM61452
Substrate
n/a
Meas. Tech.
Image-Based HTS for Selective Antagonists for GPR55
IC50
542.6552±n/a nM
Citation
 PubChem, PC Image-Based HTS for Selective Antagonists for GPR55 PubChem Bioassay (2010)[AID] 
Target
Name:
G-protein coupled receptor 55
Synonyms:
G protein-coupled receptor 55 | GPR55 | GPR55_HUMAN
Type:
PROTEIN
Mol. Mass.:
36649.72
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1292265
Residue:
319
Sequence:
MSQQNTSGDCLFDGVNELMKTLQFAVHIPTFVLGLLLNLLAIHGFSTFLKNRWPDYAATSIYMINLAVFDLLLVLSLPFKMVLSQVQSPFPSLCTLVECLYFVSMYGSVFTICFISMDRFLAIRYPLLVSHLRSPRKIFGICCTIWVLVWTGSIPIYSFHGKVEKYMCFHNMSDDTWSAKVFFPLEVFGFLLPMGIMGFCCSRSIHILLGRRDHTQDWVQQKACIYSIAASLAVFVVSFLPVHLGFFLQFLVRNSFIVECRAKQSISFFLQLSMCFSNVNCCLDVFCYYFVIKEFRMNIRAHRPSRVQLVLQDTTISRG
  
Inhibitor
Name:
BDBM61452
Synonyms:
(5E)-1-allyl-5-[[4-(4-pyridylmethyl)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone | (5E)-1-prop-2-enyl-5-[[4-(pyridin-4-ylmethyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione | (5E)-1-prop-2-enyl-5-[[[4-(pyridin-4-ylmethyl)phenyl]amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione | 1-Allyl-5-[1-(4-pyridin-4-ylmethyl-phenylamino)-meth-(E)-ylidene]-2-thioxo-dihydro-pyrimidine-4,6-dione | MLS000558175 | SMR000148891 | cid_5541621
Type:
Small organic molecule
Emp. Form.:
C20H18N4O2S
Mol. Mass.:
378.448
SMILES:
C=CCN1C(=S)NC(=O)C(=CNc2ccc(Cc3ccncc3)cc2)C1=O |w:10.10|
Structure:
Search PDB for entries with ligand similarity: