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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'L-lactate dehydrogenase A chain' and Ligand = 'BDBM50275214'   
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
L-lactate dehydrogenase A chain


(Homo sapiens (Human))
BDBM50275214
PNG
(CHEMBL4126746)
Show SMILES COc1cccc(CN2CCCCC22CC2)c1OC[C@@H](O)CN1CCOCC1 |r|
Show InChI InChI=1S/C22H34N2O4/c1-26-20-6-4-5-18(15-24-10-3-2-7-22(24)8-9-22)21(20)28-17-19(25)16-23-11-13-27-14-12-23/h4-6,19,25H,2-3,7-17H2,1H3/t19-/m0/s1
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Similars

Article
PubMed
n/an/an/an/a 390n/an/an/an/a



Capital Medical University

Curated by ChEMBL


Assay Description
Inhibition of human LDH5 using pyruvate as substrate after 10 mins


Bioorg Med Chem Lett 28: 2229-2233 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.052
BindingDB Entry DOI: 10.7270/Q21V5HGX
More data for this
Ligand-Target Pair