BDBM50010422 CHEMBL545512::H-Phe-beta-Ala-ACHPA-Ile N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]amide; dihydrochloride

SMILES CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)CCNC(=O)[C@@H](N)Cc1ccccc1)C(=O)NCc1cnc(C)nc1N

InChI Key InChIKey=OJUXFOTVKMYAOQ-UHFFFAOYSA-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:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50010422   

TargetRenin(Human)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50010422(CHEMBL545512 | H-Phe-beta-Ala-ACHPA-Ile N-[(4-amin...)
Affinity DataIC50: 20nMAssay Description:Compound was tested in vitro for inhibitory activity against human reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/21/2012
Entry Details Article
PubMed
TargetCathepsin D(Bovine)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50010422(CHEMBL545512 | H-Phe-beta-Ala-ACHPA-Ile N-[(4-amin...)
Affinity DataIC50: 1.00E+4nMAssay Description:In vitro inhibitory activity against bovine Cathepsin DMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/21/2012
Entry Details Article
PubMed
TargetPepsin A(Pig)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50010422(CHEMBL545512 | H-Phe-beta-Ala-ACHPA-Ile N-[(4-amin...)
Affinity DataIC50: 1.00E+4nMAssay Description:In vitro inhibitory activity against porcine Pepsin.More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/21/2012
Entry Details Article
PubMed