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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cystathionine gamma-lyase' and Ligand = 'BDBM50280027'   
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
Cystathionine gamma-lyase


(Homo sapiens (Human))
BDBM50280027
PNG
(CHEMBL4176749)
Show SMILES Cn1cc(Cl)c(\C=N\NC(=S)SCC(=O)Nc2ccc(cc2)C(C)(C)C)n1
Show InChI InChI=1S/C18H22ClN5OS2/c1-18(2,3)12-5-7-13(8-6-12)21-16(25)11-27-17(26)22-20-9-15-14(19)10-24(4)23-15/h5-10H,11H2,1-4H3,(H,21,25)(H,22,26)/b20-9+
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Article
PubMed
n/an/a 6.00E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of cystathionine gamma-lyase (unknown origin) assessed as reduction in cysteine formation from CPM using L-cystathionine pre-incubated for...


ACS Med Chem Lett 8: 1241-1245 (2017)


Article DOI: 10.1021/acsmedchemlett.7b00313
BindingDB Entry DOI: 10.7270/Q2N300GT
More data for this
Ligand-Target Pair