BDBM50152631 CHEMBL364212::Thioacetic acid S-[(4S,5S)-2-((E)-styryl)-5-vinyl-4,5-dihydro-oxazol-4-yl] ester

SMILES CC(=O)S[C@@H]1N=C(O[C@H]1C=C)\C=C\c1ccccc1

InChI Key InChIKey=HVCMNEIPCJLAQO-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50152631   

TargetMatrix metalloproteinase-9(Human)
North Dakota State University

Curated by ChEMBL
LigandPNGBDBM50152631(Thioacetic acid S-[(4S,5S)-2-((E)-styryl)-5-vinyl-...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibitory activity against matrix metalloprotease-9More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target72 kDa type IV collagenase(Human)
North Dakota State University

Curated by ChEMBL
LigandPNGBDBM50152631(Thioacetic acid S-[(4S,5S)-2-((E)-styryl)-5-vinyl-...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibitory activity against matrix metalloprotease-2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMacrophage metalloelastase(Human)
North Dakota State University

Curated by ChEMBL
LigandPNGBDBM50152631(Thioacetic acid S-[(4S,5S)-2-((E)-styryl)-5-vinyl-...)
Affinity DataKi: >3.00E+5nMAssay Description:Inhibitory activity against matrix metalloprotease-12More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed