Target
Hematopoietic prostaglandin D synthase
Ligand
BDBM50615821
Substrate
n/a
Meas. Tech.
ChEMBL_2304418
EC50
640±n/a nM
Citation
 Cadilla, RDeaton, DNDo, YElkins, PAEnnulat, DGuss, JHHolt, JJeune, MRKing, AGKlapwijk, JCKramer, HFKramer, NJLaffan, SBMasuria, PIMcDougal, AVMortenson, PNMusetti, CPeckham, GEPietrak, BLPoole, CPrice, DJRendina, ARSati, GSaxty, GShearer, BGShewchuk, LMSneddon, HFStewart, ELStuart, JDThomas, DNThomson, SAWard, PWilson, JWXu, TYoungman, MA The exploration of aza-quinolines as hematopoietic prostaglandin D synthase (H-PGDS) inhibitors with low brain exposure. Bioorg Med Chem 28:0 (2020) [PubMed]
Target
Name:
Hematopoietic prostaglandin D synthase
Synonyms:
2.5.1.18 | 5.3.99.2 | GST class-sigma | Glutathione S-transferase | Glutathione-dependent PGD synthase | Glutathione-requiring prostaglandin D synthase | Gsts | H-PGDS | HPGDS_RAT | Hematopoietic prostaglandin D synthase | Hpgds | Pgds | Prostaglandin-H2 D-isomerase | Ptgds2
Type:
PROTEIN
Mol. Mass.:
23295.19
Organism:
Rattus norvegicus
Description:
ChEMBL_118881
Residue:
199
Sequence:
MPNYKLLYFNMRGRAEIIRYIFAYLDIKYEDHRIEQADWPKIKPTLPFGKIPVLEVEGLTLHQSLAIARYLTKNTDLAGKTELEQCQVDAVVDTLDDFMSLFPWAEENQDLKERTFNDLLTRQAPHLLKDLDTYLGDKEWFIGNYVTWADFYWDICSTTLLVLKPDLLGIYPRLVSLRNKVQAIPAISAWILKRPQTKL
  
Inhibitor
Name:
BDBM50615821
Synonyms:
CHEMBL5282999
Type:
Small organic molecule
Emp. Form.:
C16H16N4O2
Mol. Mass.:
296.3238
SMILES:
O=C(N[C@H]1CCNC1=O)c1cnc2nc(ccc2c1)C1CC1 |r|
Structure:
Search PDB for entries with ligand similarity: