Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetHematopoietic prostaglandin D synthase
LigandBDBM50550009
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2026072 (CHEMBL4679885)
IC50 300±n/a nM
Citation Yokoo, HShibata, NNaganuma, MMurakami, YFujii, KIto, TAritake, KNaito, MDemizu, Y Development of a Hematopoietic Prostaglandin D Synthase-Degradation Inducer. ACS Med Chem Lett12:236-241 (2021) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Hematopoietic prostaglandin D synthase
Name:Hematopoietic prostaglandin D synthase
Synonyms:GSTS | Glutathione-dependent PGD synthetase | Glutathione-requiring prostaglandin D synthase | H-PGDS | HPGDS | HPGDS_HUMAN | Hematopoietic prostaglandin D synthase | Hematopoietic prostaglandin D synthase (H-PGDS) | Hematopoietic prostaglandin D synthase (HPGDS) | PGDS | PTGDS2 | Prostaglandin D | Prostaglandin D Synthase
Type:Enzyme
Mol. Mass.:23341.07
Organism:Homo sapiens (Human)
Description:The protein was expressed in E. coli strain BL21(DE3) with an N-terminal 6-His tag.
Residue:199
Sequence:
MPNYKLTYFNMRGRAEIIRYIFAYLDIQYEDHRIEQADWPEIKSTLPFGKIPILEVDGLT
LHQSLAIARYLTKNTDLAGNTEMEQCHVDAIVDTLDDFMSCFPWAEKKQDVKEQMFNELL
TYNAPHLMQDLDTYLGGREWLIGNSVTWADFYWEICSTTLLVFKPDLLDNHPRLVTLRKK
VQAIPAVANWIKRRPQTKL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50550009
n/a
NameBDBM50550009
Synonyms:CHEMBL4758395
TypeSmall organic molecule
Emp. Form.C54H65N9O13
Mol. Mass.1048.1464
SMILESCN1C(=O)CCC(N2C(=O)c3cccc(NCCOCCOCCOCCOCCOCCC(=O)N4CCN(CC4)C(=O)C4CCN(CC4)c4ccc(NC(=O)c5cnc(Oc6ccccc6)nc5)cc4)c3C2=O)C1=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: