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Compile Data Set for Download or QSAR

Found 2 hits of non-affinity data for polymerid = 1234,1262,1264,50001013   
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))
BDBM15526
PNG
(N-{[(3S,5S)-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrol...)
Show SMILES O=C(NC[C@@H]1CN[C@@H](C1)C(=O)N1CCSC1)c1cscn1
Show InChI InChI=1S/C13H18N4O2S2/c18-12(11-6-21-7-16-11)15-5-9-3-10(14-4-9)13(19)17-1-2-20-8-17/h6-7,9-10,14H,1-5,8H2,(H,15,18)/t9-,10-/m0/s1
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n/an/an/an/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The DPP activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 355 nm and meas...


Bioorg Med Chem Lett 17: 2005-12 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.026
BindingDB Entry DOI: 10.7270/Q20G3HCQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Dipeptidyl peptidase IV


(Sus scrofa (pig))
BDBM11558
PNG
((3S)-2-[(3R)-3-amino-4-(2-fluorophenyl)butanoyl]-1...)
Show SMILES N[C@@H](CC(=O)N1Cc2ccccc2C[C@H]1C(N)=O)Cc1ccccc1F
Show InChI InChI=1S/C20H22FN3O2/c21-17-8-4-3-6-14(17)9-16(22)11-19(25)24-12-15-7-2-1-5-13(15)10-18(24)20(23)26/h1-8,16,18H,9-12,22H2,(H2,23,26)/t16-,18+/m1/s1
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Similars

DrugBank
PDB
Article
PubMed
n/an/an/an/an/an/an/a7.425



Santhera Pharmaceuticals



Assay Description
The DPP4 activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 370 nm and mea...


Bioorg Med Chem Lett 16: 1744-8 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.103
BindingDB Entry DOI: 10.7270/Q2639MZX
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)