BDBM50035235 CHEMBL2372437::N-[1-(Carbamoylmethyl-carbamoyl)-ethyl]-N''-hydroxy-2-isobutyl-malonamide

SMILES CC(C)C[C@H](C(=O)NO)C(=O)N[C@@H](C)C(=O)NCC(N)=O

InChI Key InChIKey=FGSNBBSHVNLDMX-YUMQZZPRSA-N

Data  2 KI  5 IC50

PDB links: 1 PDB ID matches this monomer.

  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 = 50035235   

TargetThermolysin(Bacillus thermoproteolyticus)
University Of Marburg

Curated by ChEMBL
LigandPNGBDBM50035235(CHEMBL2372437 | N-[1-(Carbamoylmethyl-carbamoyl)-e...)
Affinity DataKi:  478nMAssay Description:pKi value expresses binding affinity against thermolysin pKi = -logKi (where Ki is in mol/L)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThermolysin(Bacillus thermoproteolyticus)
University Of Marburg

Curated by ChEMBL
LigandPNGBDBM50035235(CHEMBL2372437 | N-[1-(Carbamoylmethyl-carbamoyl)-e...)
Affinity DataIC50:  64nMAssay Description:Compound was tested in vitro for inhibitory activity against thermolysinMore data for this Ligand-Target Pair
In DepthDetails Article
TargetThermolysin(Bacillus thermoproteolyticus)
University Of Marburg

Curated by ChEMBL
LigandPNGBDBM50035235(CHEMBL2372437 | N-[1-(Carbamoylmethyl-carbamoyl)-e...)
Affinity DataIC50:  175nMAssay Description:Inhibitory activity against thermolysin with 0.5 uM [Leu5]-enkephalin (NEN)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed