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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50430419'   
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
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50430419
PNG
(CHEMBL2334693)
Show SMILES N[C@@H](C1CCN(CC1)S(=O)(=O)c1ccc(Cl)cc1)C(=O)N1[C@H]2C[C@H]2C[C@H]1C#N |r|
Show InChI InChI=1S/C19H23ClN4O3S/c20-14-1-3-16(4-2-14)28(26,27)23-7-5-12(6-8-23)18(22)19(25)24-15(11-21)9-13-10-17(13)24/h1-4,12-13,15,17-18H,5-10,22H2/t13-,15+,17+,18+/m1/s1
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MMDB

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Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human DPP4 using gly-pro-para-nitroanilide as substrate


Bioorg Med Chem Lett 23: 1622-5 (2013)


Article DOI: 10.1016/j.bmcl.2013.01.104
BindingDB Entry DOI: 10.7270/Q2K075N4
More data for this
Ligand-Target Pair