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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosylhomocysteinase' and Ligand = 'BDBM50096908'   
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
Adenosylhomocysteinase


(Homo sapiens (Human))
BDBM50096908
PNG
(CHEMBL3580894)
Show SMILES CNc1ncnc2n(ccc12)[C@@H]1C=C(CO)[C@@H](O)[C@H]1O |r,t:14|
Show InChI InChI=1S/C13H16N4O3/c1-14-12-8-2-3-17(13(8)16-6-15-12)9-4-7(5-18)10(19)11(9)20/h2-4,6,9-11,18-20H,5H2,1H3,(H,14,15,16)/t9-,10-,11+/m1/s1
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MMDB

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Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human placental AdoHcy hydrolase expressed in Escherichia coli BL21 using AdoHcy as substrate preincubated for 10 mins foll...


J Med Chem 58: 5108-20 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00553
BindingDB Entry DOI: 10.7270/Q2T155DR
More data for this
Ligand-Target Pair