BDBM50010405 CHEMBL113593::{3-[(3-{1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-methylsulfanyl]-1-benzyl-2-hydroxy-propyl}-carbamic acid tert-butyl ester

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

InChI Key InChIKey=GHOSSUACYAUAKQ-WITQEOTBSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50010405   

TargetRenin(Homo sapiens (Human))
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50010405(CHEMBL113593 | {3-[(3-{1-[(4-Amino-2-methyl-pyrimi...)
Affinity DataIC50:  6.30nMAssay Description:In vitro for inhibitory activity against human reninMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin D(Bos taurus)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50010405(CHEMBL113593 | {3-[(3-{1-[(4-Amino-2-methyl-pyrimi...)
Affinity DataIC50: >1.00E+5nMAssay Description:In vitro inhibitory activity against bovine Cathepsin DMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPepsin A(Porcine)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50010405(CHEMBL113593 | {3-[(3-{1-[(4-Amino-2-methyl-pyrimi...)
Affinity DataIC50: >1.00E+5nMAssay Description:In vitro inhibitory activity against porcine Pepsin.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed