BDBM50025514 2-{2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phenyl-propionylamino)-4-methyl-pentanoylamino]-propionylamino}-3-hydroxy-6-methyl-heptanoylamino)-3-phenyl-propionylamino]-3-methyl-butyrylamino}-4-methyl-pentanoic acid methyl ester::CHEMBL3142505

SMILES COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C

InChI Key InChIKey=PQWNFSMMAWCRFG-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 = 50025514   

TargetPepsin A(Porcine)
TBA

Curated by ChEMBL
LigandPNGBDBM50025514(2-{2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phe...)
Affinity DataKi:  0.640nMAssay Description:Compound was tested for inhibition of pepsin.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin D(Bos taurus)
TBA

Curated by ChEMBL
LigandPNGBDBM50025514(2-{2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phe...)
Affinity DataKi:  5.80nMAssay Description:Inhibition of cathepsin D.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGastricsin(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50025514(2-{2-[2-(4-{2-[2-(2-tert-Butoxycarbonylamino-3-phe...)
Affinity DataKi:  9.20nMAssay Description:Compound was tested for inhibition of Rhizopus chinensis pepsin.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed