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Compile Data Set for Download or QSAR

Found 1 hit from Addis Ababa University   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adenosine deaminase


(Homo sapiens (human))
BDBM22917
PNG
(1-(1-hydroxy-4-phenylbutan-2-yl)-1H-imidazole-4-ca...)
Show SMILES NC(=O)c1cn(cn1)C(CO)CCc1ccccc1
Show InChI InChI=1S/C14H17N3O2/c15-14(19)13-8-17(10-16-13)12(9-18)7-6-11-4-2-1-3-5-11/h1-5,8,10,12,18H,6-7,9H2,(H2,15,19)
PDB
MMDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
PDB
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Patents


Similars

PDB
Article
PubMed
5.90E+6n/an/an/an/an/an/an/an/a



Addis Ababa University

Curated by ChEMBL


Assay Description
Inhibition of human ADA


Bioorg Med Chem 15: 3728-36 (2007)


Article DOI: 10.1016/j.bmc.2007.03.048
BindingDB Entry DOI: 10.7270/Q21Z4433
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)