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Target
17-beta-hydroxysteroid dehydrogenase type 1
Ligand
BDBM50620428
Substrate
n/a
Meas. Tech.
ChEMBL_2324321
IC50
80±n/a nM
Citation
 Salah, M; Tahoun, M; Rudzitis-Auth, J; Stotz, L; van Koppen, CJ; Laschke, MW; Abdelsamie, AS; Frotscher, M Potent Dual Inhibitors of Steroid Sulfatase and 17β-Hydroxysteroid Dehydrogenase Type 1 with a Suitable Pharmacokinetic Profile for  J Med Chem 66:8975-8992 (2023) [PubMed] 
Target
Name:
17-beta-hydroxysteroid dehydrogenase type 1
Synonyms:
17-beta-HSD 1 | 17-beta-Hydroxysteroid Dehydrogenase 1 (17-beta-HSD1) | 20 alpha-hydroxysteroid dehydrogenase | 20-alpha-HSD | DHB1_HUMAN | E17KSR | E2DH | EDH17B1 | EDH17B2 | EDHB17 | Estradiol 17-beta-dehydrogenase 1 | Estradiol 17-beta-dehydrogenase 1 (17beta-HSD1) | HSD17B1 | Placental 17-beta-hydroxysteroid dehydrogenase | SDR28C1
Type:
Enzyme
Mol. Mass.:
34945.13
Organism:
Human
Description:
P14061
Residue:
328
Sequence:
MARTVVLITGCSSGIGLHLAVRLASDPSQSFKVYATLRDLKTQGRLWEAARALACPPGSLETLQLDVRDSKSVAAARERVTEGRVDVLVCNAGLGLLGPLEALGEDAVASVLDVNVVGTVRMLQAFLPDMKRRGSGRVLVTGSVGGLMGLPFNDVYCASKFALEGLCESLAVLLLPFGVHLSLIECGPVHTAFMEKVLGSPEEVLDRTDIHTFHRFYQYLAHSKQVFREAAQNPEEVAEVFLTALRAPKPTLRYFTTERFLPLLRMRLDDPSGSNYVTAMHREVFGDVPAKAEAGAEAGGGAGPGAEDEAGRGAVGDPELGDPPAAPQ
  
Inhibitor
Name:
BDBM50620428
Synonyms:
CHEMBL5417947
Type:
Small organic molecule
Emp. Form.:
C20H20N2O6S
Mol. Mass.:
416.46
SMILES:
CN(C(=O)c1ccc(o1)-c1cc(C)c(O)c(C)c1)c1cccc(OS(N)(=O)=O)c1
Structure:
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