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SMILES: CC[C@H](C)[C@H](N)C(=O)N1C[S+]([O-])C[C@H]1C#N

InChI Key: InChIKey=RRQNWILIXWSHFX-CDKBEWALSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50450427   
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))
BDBM50450427
PNG
(CHEMBL2115247)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N1C[S+]([O-])C[C@H]1C#N |r|
Show InChI InChI=1S/C10H17N3O2S/c1-3-7(2)9(12)10(14)13-6-16(15)5-8(13)4-11/h7-9H,3,5-6,12H2,1-2H3/t7-,8+,9-,16?/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
34n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human Dipeptidyl peptidase IV


Bioorg Med Chem Lett 6: 2745-2748 (1996)


Article DOI: 10.1016/S0960-894X(96)00491-X
BindingDB Entry DOI: 10.7270/Q2MP537C
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50450427
PNG
(CHEMBL2115247)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N1C[S+]([O-])C[C@H]1C#N |r|
Show InChI InChI=1S/C10H17N3O2S/c1-3-7(2)9(12)10(14)13-6-16(15)5-8(13)4-11/h7-9H,3,5-6,12H2,1-2H3/t7-,8+,9-,16?/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
440n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human Dipeptidyl peptidase IV


Bioorg Med Chem Lett 6: 2745-2748 (1996)


Article DOI: 10.1016/S0960-894X(96)00491-X
BindingDB Entry DOI: 10.7270/Q2MP537C
More data for this
Ligand-Target Pair