BDBM50043797 (R)-2-Benzyloxycarbonylamino-3-(4-hydroxy-phenyl)-propionic acid::CHEMBL305478::Cbz-D-Tyr

SMILES OC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)OCc1ccccc1

InChI Key InChIKey=MCRMUCXATQAAMN-UHFFFAOYSA-N

Data  2 KI  2 IC50  1 ITC

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50043797   

TargetStromelysin-1(Human)
Warner-Lambert

Curated by ChEMBL
LigandPNGBDBM50043797(Cbz-D-Tyr | CHEMBL305478 | (R)-2-Benzyloxycarbonyl...)
Affinity DataIC50: 4.32E+5nMAssay Description:In vitro inhibition of recombinant stromelysin catalytic domain.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetStromelysin-1(Human)
Warner-Lambert

Curated by ChEMBL
LigandPNGBDBM50043797(Cbz-D-Tyr | CHEMBL305478 | (R)-2-Benzyloxycarbonyl...)
Affinity DataIC50: 4.50E+5nMAssay Description:Inhibition of recombinant full length stromelysin (FLS).More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetStromelysin-1(Human)
Warner-Lambert

Curated by ChEMBL
LigandPNGBDBM50043797(Cbz-D-Tyr | CHEMBL305478 | (R)-2-Benzyloxycarbonyl...)
Affinity DataKi:  3.56E+5nMAssay Description:Inhibition of recombinant stromelysin catalytic domain (SCD)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetStromelysin-1(Human)
Warner-Lambert

Curated by ChEMBL
LigandPNGBDBM50043797(Cbz-D-Tyr | CHEMBL305478 | (R)-2-Benzyloxycarbonyl...)
Affinity DataKi:  3.77E+5nMAssay Description:Inhibition of recombinant full length stromelysin (FLS)More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50043797   

HostPNGBDBM36126(gamma-cyclodextrin)
Japan Science and Technology Agency

GuestPNGBDBM50043797(Cbz-D-Tyr | CHEMBL305478 | (R)-2-Benzyloxycarbonyl...)
ITC DataΔG°: -3.06kcal/mole −TΔS°: 1.53kcal/mole ΔH°: -4.59kcal/mole logk: 175
pH: 6.9 T: 25.00°C