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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serotonin N-acetyltransferase (AANAT)' and Ligand = 'BDBM85588'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serotonin N-acetyltransferase (AANAT)


(Homo sapiens (Human))
BDBM85588
PNG
(AANAT Inhibitor, 8e)
Show SMILES BrCC(=O)NCCc1csc2ccccc12
Show InChI InChI=1S/C12H12BrNOS/c13-7-12(15)14-6-5-9-8-16-11-4-2-1-3-10(9)11/h1-4,8H,5-7H2,(H,14,15)
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 680n/an/an/an/a6.837



Université de Lille



Assay Description
The compounds were evaluated in a human serotonin N-acetyltransferase assay.


J Enzyme Inhib Med Chem 17: 409-14 (2002)


Article DOI: 10.1080/1475636021000005721
BindingDB Entry DOI: 10.7270/Q2610XWN
More data for this
Ligand-Target Pair