BDBM50040394 (2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(less polar)::(2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-5-((2R)-2(((benzyloxy)(3-phenylpropyl)phosphoryl)oxy)-hexanamido)hexanamide(more polar)::CHEMBL146651

SMILES CCCCNC(=O)[C@H](C)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)OP(=O)(CCCc1ccccc1)OC(=O)c1ccccc1

InChI Key InChIKey=DFOCXJWVMPSDCT-UWKZYUMSSA-N

Data  6 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 6 hits for monomerid = 50040394   

TargetCathepsin D(Bos taurus)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50040394((2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-...)
Affinity DataIC50:  2.65E+3nMAssay Description:In vitro inhibition of bovine cathepsin D.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50040394((2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-...)
Affinity DataIC50:  10.5nMAssay Description:In vitro inhibition of human renin.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin D(Bos taurus)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50040394((2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-...)
Affinity DataIC50:  2.65E+3nMAssay Description:In vitro inhibition of bovine cathepsin D.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPepsin A(Porcine)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50040394((2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-...)
Affinity DataIC50: >1.00E+4nMAssay Description:In vitro inhibition of porcine pepsin.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPepsin A(Porcine)
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50040394((2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-...)
Affinity DataIC50: >1.00E+4nMAssay Description:In vitro inhibition of porcine pepsin.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRenin(Homo sapiens (Human))
E. Merck Darmstadt

Curated by ChEMBL
LigandPNGBDBM50040394((2R,4S,5S)N-butyl-6-cyclohexyl-4-hydroxy-2-methyl-...)
Affinity DataIC50:  10.5nMAssay Description:In vitro inhibition of human renin.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed