BDBM50227057 (S)-2-((S)-2-((S)-2-((S)-1-((2S,3S)-3-((S)-2-((S)-5-amino-5-oxo-2-((S)-pyrrolidine-2-carboxamido)pentanamido)-3-methylbutanamido)-2-hydroxy-4-phenylbutanoyl)pyrrolidine-2-carboxamido)-3-methylbutanamido)-4-(methylthio)butanamido)-3-(1H-imidazol-5-yl)propanoic acid::(S)-2-((S)-2-((S)-2-((S)-1-((2S,3S)-3-((S)-2-((S)-5-amino-5-oxo-2-((S)-pyrrolidine-2-carboxamido)pentanamido)-3-methylbutanamido)-2-hydroxy-4-phenylbutanoyl)pyrrolidine-5-carboxamido)-3-methylbutanamido)-4-(methylthio)butanamido)-3-(1H-imidazol-4-yl)propa::CHEMBL233025::H-Pro-Gln-Val-Apns-Pro-Val-Met-His-OH::H-Pro-Gln-Val-Leu-Pro-Val-Met-His-Pro-OH::KNI-10161

SMILES CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(O)=O

InChI Key InChIKey=VJXOFNUAQFCRFQ-QTCJXMFWSA-N

Data  3 IC50

  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 = 50227057   

TargetProtease(Human T-lymphotropic virus 1)
Kyoto Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50227057((S)-2-((S)-2-((S)-2-((S)-1-((2S,3S)-3-((S)-2-((S)-...)
Affinity DataIC50:  159nMAssay Description:Inhibition of HTLV1 protease1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProtease(Human T-cell leukemia virus type I)
Kyoto Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50227057((S)-2-((S)-2-((S)-2-((S)-1-((2S,3S)-3-((S)-2-((S)-...)
Affinity DataIC50:  159nMAssay Description:Inhibition of HTLV1 protease L40I mutantMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGag-Pro polyprotein(Human T-cell leukemia virus 1 (strain Japan ATK-1 ...)
Kyoto Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50227057((S)-2-((S)-2-((S)-2-((S)-1-((2S,3S)-3-((S)-2-((S)-...)
Affinity DataIC50:  159nMAssay Description:Inhibition of HTLV1 protease L40I mutant expressed in Escherichia coli BL21(DE3)pLysSMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed