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BDBM50161361 2-((S)-2-Amino-3-methyl-pentanoyl)-pyrazolidine-1-carboxylic acid benzyl ester; hydrochloride::CHEMBL534473

SMILES: CCC(C)[C@H](N)C(=O)N1CCCN1C(=O)OCc1ccccc1

InChI Key: InChIKey=WVGMVNNUIOKATB-WUJWULDRSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50161361   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase IV


(Rattus norvegicus (rat))
BDBM50161361
PNG
(2-((S)-2-Amino-3-methyl-pentanoyl)-pyrazolidine-1-...)
Show SMILES CCC(C)[C@H](N)C(=O)N1CCCN1C(=O)OCc1ccccc1
Show InChI InChI=1S/C17H25N3O3/c1-3-13(2)15(18)16(21)19-10-7-11-20(19)17(22)23-12-14-8-5-4-6-9-14/h4-6,8-9,13,15H,3,7,10-12,18H2,1-2H3/t13?,15-/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.33E+4n/an/an/an/an/an/a



Korea Research Institute of Chemical Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against dipeptidyl peptidase IV (DP-IV)


Bioorg Med Chem Lett 15: 1337-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.01.020
BindingDB Entry DOI: 10.7270/Q2NK3FS6
More data for this
Ligand-Target Pair