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BDBM50206053 ((2S,4S)-4-(4-phenylpiperidin-1-yl)pyrrolidin-2-yl)(thiazolidin-3-yl)methanone::CHEMBL395606

SMILES: O=C([C@@H]1C[C@@H](CN1)N1CCC(CC1)c1ccccc1)N1CCSC1

InChI Key: InChIKey=ZRRZCCILRVBHFY-ROUUACIJSA-N

Data: 2 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 2 hits for monomerid = 50206053   
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
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50206053
PNG
(((2S,4S)-4-(4-phenylpiperidin-1-yl)pyrrolidin-2-yl...)
Show SMILES O=C([C@@H]1C[C@@H](CN1)N1CCC(CC1)c1ccccc1)N1CCSC1
Show InChI InChI=1S/C19H27N3OS/c23-19(22-10-11-24-14-22)18-12-17(13-20-18)21-8-6-16(7-9-21)15-4-2-1-3-5-15/h1-5,16-18,20H,6-14H2/t17-,18-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 5.60n/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in human plasma by fluorescence assay


Bioorg Med Chem Lett 17: 2618-21 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.110
BindingDB Entry DOI: 10.7270/Q29023GP
More data for this
Ligand-Target Pair
Dipeptidyl peptidase IV


(Rattus norvegicus (rat))
BDBM50206053
PNG
(((2S,4S)-4-(4-phenylpiperidin-1-yl)pyrrolidin-2-yl...)
Show SMILES O=C([C@@H]1C[C@@H](CN1)N1CCC(CC1)c1ccccc1)N1CCSC1
Show InChI InChI=1S/C19H27N3OS/c23-19(22-10-11-24-14-22)18-12-17(13-20-18)21-8-6-16(7-9-21)15-4-2-1-3-5-15/h1-5,16-18,20H,6-14H2/t17-,18-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.60n/an/an/an/an/an/a



Mitsubishi Pharma Corporation

Curated by ChEMBL


Assay Description
Inhibition of DPP4 in rat plasma by fluorescence assay


Bioorg Med Chem Lett 17: 2618-21 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.110
BindingDB Entry DOI: 10.7270/Q29023GP
More data for this
Ligand-Target Pair