BDBM50076343 (S)-3-Phenyl-2-[3-(5-thioxo-4,5-dihydro-[1,3,4]thiadiazol-2-yl)-ureido]-propionamide::CHEMBL39553

SMILES NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1nnc(S)s1

InChI Key InChIKey=WFELCPTZICREII-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50076343   

TargetStromelysin-1(Human)
Pharmacia and Upjohn

Curated by ChEMBL
LigandPNGBDBM50076343((S)-3-Phenyl-2-[3-(5-thioxo-4,5-dihydro-[1,3,4]thi...)
Affinity DataKi:  3.30E+3nMAssay Description:Binding affinity for matrix metalloprotease-3More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetStromelysin-1(Human)
Pharmacia and Upjohn

Curated by ChEMBL
LigandPNGBDBM50076343((S)-3-Phenyl-2-[3-(5-thioxo-4,5-dihydro-[1,3,4]thi...)
Affinity DataKi:  3.30E+3nMAssay Description:Inhibition of human stromelysin-1 (MMP-3)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetInterstitial collagenase(Human)
Pharmacia and Upjohn

Curated by ChEMBL
LigandPNGBDBM50076343((S)-3-Phenyl-2-[3-(5-thioxo-4,5-dihydro-[1,3,4]thi...)
Affinity DataKi: >2.00E+5nMAssay Description:Binding affinity for matrix metalloprotease-1More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target72 kDa type IV collagenase(Human)
University of California San Francisco

Curated by ChEMBL
LigandPNGBDBM50076343((S)-3-Phenyl-2-[3-(5-thioxo-4,5-dihydro-[1,3,4]thi...)
Affinity DataKi: >2.00E+5nMAssay Description:Inhibition of human Matrix metalloprotease-2 (gelatinase-A)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed