BindingDB logo
myBDB logout

null

SMILES: CCC(C)[C@H](N)C(=O)N1CSCCC1C#N

InChI Key: InChIKey=NMZWRTSAOXUWBU-RTBKNWGFSA-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 1 hit for monomerid = 50288305   
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))		BDBM50288305
PNG
(3-((S)-2-Amino-3-methyl-pentanoyl)-[1,3]thiazinane...)
Show SMILES CCC(C)[C@H](N)C(=O)N1CSCCC1C#N
Show InChI InChI=1S/C11H19N3OS/c1-3-8(2)10(13)11(15)14-7-16-5-4-9(14)6-12/h8-10H,3-5,7,13H2,1-2H3/t8?,9?,10-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
 6.00E+3n/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