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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosylhomocysteinase' and Ligand = 'BDBM50051438'   
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))
BDBM50051438
PNG
((1R,2R,3S,4R)-4-(6-Amino-purin-9-yl)-2,3-dihydroxy...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1C[C@@H](C=O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C11H13N5O3/c12-10-7-11(14-3-13-10)16(4-15-7)6-1-5(2-17)8(18)9(6)19/h2-6,8-9,18-19H,1H2,(H2,12,13,14)/t5-,6+,8+,9-/m0/s1
PDB
MMDB

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PC cid
PC sid
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Article
PubMed
273n/an/an/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards purified recombinant human placental S-adenosyl-L-homocysteine hydrolase


J Med Chem 39: 2347-53 (1996)


Article DOI: 10.1021/jm950916u
BindingDB Entry DOI: 10.7270/Q20Z72CP
More data for this
Ligand-Target Pair
3D
3D Structure (docked)