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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial' and Ligand = 'BDBM273020'   
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
Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial


(Homo sapiens (Human))
BDBM273020
PNG
((R)-2-(5-ethyl-6-methyl-7-oxo-6,7-dihydro[1,3]thia...)
Show SMILES CCc1nc2sc(nc2c(=O)n1C)[C@H]1CCCN1C(=O)Oc1ccccc1
Show InChI InChI=1S/C19H20N4O3S/c1-3-14-20-17-15(18(24)22(14)2)21-16(27-17)13-10-7-11-23(13)19(25)26-12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10-11H2,1-2H3/t13-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 25n/an/an/an/a8.0n/a



MITSUBISHI TANABE PHARMA CORPORATION

US Patent


Assay Description
The inhibitory action of the test compound on human recombinant KAT-II was determined by the following method.To a reaction mixture (45 μL) cont...


US Patent US10065972 (2018)

More data for this
Ligand-Target Pair