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SMILES: N[C@H]1C[C@H](CO[C@@H]1c1cc(F)ccc1F)N1Cc2[nH]nc(NC(=O)c3nccs3)c2C1

InChI Key: InChIKey=GFCFPPBBZUPLGE-XQAQDONZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50134189   
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
Prolyl endopeptidase FAP


(Bos taurus)
BDBM50134189
PNG
(CHEMBL3735129)
Show SMILES N[C@H]1C[C@H](CO[C@@H]1c1cc(F)ccc1F)N1Cc2[nH]nc(NC(=O)c3nccs3)c2C1 |r|
Show InChI InChI=1S/C20H20F2N6O2S/c21-10-1-2-14(22)12(5-10)17-15(23)6-11(9-30-17)28-7-13-16(8-28)26-27-18(13)25-19(29)20-24-3-4-31-20/h1-5,11,15,17H,6-9,23H2,(H2,25,26,27,29)/t11-,15+,17-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of bovine serum FAP


Bioorg Med Chem Lett 25: 5767-71 (2015)


BindingDB Entry DOI: 10.7270/Q208675S
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50134189
PNG
(CHEMBL3735129)
Show SMILES N[C@H]1C[C@H](CO[C@@H]1c1cc(F)ccc1F)N1Cc2[nH]nc(NC(=O)c3nccs3)c2C1 |r|
Show InChI InChI=1S/C20H20F2N6O2S/c21-10-1-2-14(22)12(5-10)17-15(23)6-11(9-30-17)28-7-13-16(8-28)26-27-18(13)25-19(29)20-24-3-4-31-20/h1-5,11,15,17H,6-9,23H2,(H2,25,26,27,29)/t11-,15+,17-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.30n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP4 expressed in Sf9 cells using Gly-Pro-AMC substrate after 30 mins by plate reader analysis


Bioorg Med Chem Lett 25: 5767-71 (2015)


BindingDB Entry DOI: 10.7270/Q208675S
More data for this
Ligand-Target Pair