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BDBM50135043 2-Amino-3-methyl-1-thiazolidin-3-yl-pentan-1-one::3-methyl-1-oxo-1-(1,3-thiazolidin-3-yl)pentan-2-aminium::CHEMBL357606

SMILES: CCC(C)C(N)C(=O)N1CCSC1

InChI Key: InChIKey=WCRLBFHWFPELKW-UHFFFAOYSA-N

Data: 1 KI  3 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50135043   
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
Oligopeptide transporter small intestine isoform


(Homo sapiens (Human))
BDBM50135043
PNG
(2-Amino-3-methyl-1-thiazolidin-3-yl-pentan-1-one |...)
Show SMILES CCC(C)C(N)C(=O)N1CCSC1
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3
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Article
PubMed
6.30E+6n/an/an/an/an/an/an/an/a



Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL


Assay Description
Inhibition constant (Ki) for human intestinal peptide carrier


J Med Chem 46: 5725-34 (2003)


Article DOI: 10.1021/jm030976x
BindingDB Entry DOI: 10.7270/Q22N531C
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IV


(Porphyromonas gingivalis)
BDBM50135043
PNG
(2-Amino-3-methyl-1-thiazolidin-3-yl-pentan-1-one |...)
Show SMILES CCC(C)C(N)C(=O)N1CCSC1
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3
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Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



University of Warwick

Curated by ChEMBL


Assay Description
Inhibition of Porphyromonas gingivalis N-terminal His-tagged DPP4 expressed in Escherichia coli using Gly-Pro-p-nitroanilide as substrate


Eur J Med Chem 139: 482-491 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.024
BindingDB Entry DOI: 10.7270/Q25B050P
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50135043
PNG
(2-Amino-3-methyl-1-thiazolidin-3-yl-pentan-1-one |...)
Show SMILES CCC(C)C(N)C(=O)N1CCSC1
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3
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Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



University of Antwerp (UIA)

Curated by ChEMBL


Assay Description
Inhibitory activity against Dipeptidylpeptidase IV (DPP IV)


J Med Chem 46: 5005-14 (2003)


Article DOI: 10.1021/jm0308803
BindingDB Entry DOI: 10.7270/Q2W37X2F
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50135043
PNG
(2-Amino-3-methyl-1-thiazolidin-3-yl-pentan-1-one |...)
Show SMILES CCC(C)C(N)C(=O)N1CCSC1
Show InChI InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 2.80E+4n/an/an/an/an/an/a



University of Antwerp (UIA)

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against Dipeptidylpeptidase II (DPP II)


J Med Chem 46: 5005-14 (2003)


Article DOI: 10.1021/jm0308803
BindingDB Entry DOI: 10.7270/Q2W37X2F
More data for this
Ligand-Target Pair