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Target
Serotonin N-acetyltransferase
Ligand
BDBM50224330
Substrate
n/a
Meas. Tech.
ChEMBL_450671 (CHEMBL900954)
IC50
25200±n/a nM
Citation
 Szewczuk, LM; Saldanha, SA; Ganguly, S; Bowers, EM; Javoroncov, M; Karanam, B; Culhane, JC; Holbert, MA; Klein, DC; Abagyan, R; Cole, PA De novo discovery of serotonin N-acetyltransferase inhibitors. J Med Chem 50:5330-8 (2007) [PubMed]  Article 
Target
Name:
Serotonin N-acetyltransferase
Synonyms:
AANAT | SNAT | SNAT_SHEEP
Type:
PROTEIN
Mol. Mass.:
23086.34
Organism:
Ovis aries
Description:
ChEMBL_450671
Residue:
207
Sequence:
MSTPSVHCLKPSPLHLPSGIPGSPGRQRRHTLPANEFRCLTPEDAAGVFEIEREAFISVSGNCPLNLDEVQHFLTLCPELSLGWFVEGRLVAFIIGSLWDEERLTQESLALHRPRGHSAHLHALAVHRSFRQQGKGSVLLWRYLHHVGAQPAVRRAVLMCEDALVPFYQRFGFHPAGPCAIVVGSLTFTEMHCSLRGHAALRRNSDR
  
Inhibitor
Name:
BDBM50224330
Synonyms:
2-{5-[1-(4-methyl-benzyl)-2-oxo-2,3-dihydro-1H-indol-3-yl]-4-oxo-2-thioxo-thiazolidin-3-yl}-ethanesulfonic acid | CHEMBL237832
Type:
Small organic molecule
Emp. Form.:
C21H20N2O5S3
Mol. Mass.:
476.589
SMILES:
Cc1ccc(CN2C(=O)C(c3ccccc23)c2sc(=S)n(CCS(O)(=O)=O)c2O)cc1 |w:9.8|
Structure:
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