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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hypoxanthine-guanine phosphoribosyltransferase' and Ligand = 'BDBM50519496'   
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
Hypoxanthine-guanine phosphoribosyltransferase


(Homo sapiens (Human))
BDBM50519496
PNG
(CHEMBL4439813)
Show SMILES OC[C@@H](Cn1cnc2c1[nH]c(=O)[nH]c2=O)n1cc(nn1)P(O)(O)=O |r|
Show InChI InChI=1S/C10H12N7O6P/c18-3-5(17-2-6(14-15-17)24(21,22)23)1-16-4-11-7-8(16)12-10(20)13-9(7)19/h2,4-5,18H,1,3H2,(H2,21,22,23)(H2,12,13,19,20)/t5-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
>5.00E+5n/an/an/an/an/an/an/an/a



Universit£ Montpellier

Curated by ChEMBL


Assay Description
Inhibition of human HGPRT using Prib-PP as substrate by Hanes-plot based method


J Med Chem 62: 8365-8391 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00182
BindingDB Entry DOI: 10.7270/Q2T1571N
More data for this
Ligand-Target Pair