BDBM50022582 CHEMBL53139::Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-sulfonyl)-propionylamino]-3-(3H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid butylamide

SMILES CCCCNC(=O)[C@@H](CC(O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C(Cc1ccccc1)CS(=O)(=O)C(C)(C)C)C(C)C

InChI Key InChIKey=GGKXIITZBSPCQP-UHFFFAOYSA-N

Data  9 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 9 hits for monomerid = 50022582   

TargetRenin(Rat)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 400nMAssay Description:In vitro inhibition of rat plasma reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCathepsin D(Bovine)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 3.20E+3nMAssay Description:In vitro inhibition of bovine cathepsin DMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 2nMAssay Description:In vitro inhibition of Human plasma reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 8.20E+3nMAssay Description:In vitro inhibition of porcine plasma reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 3nMAssay Description:In vitro inhibition of dog plasma reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 2nMpH: 7.2Assay Description:In vitro inhibition of purified Human kidney renin (250 pg/mL) incubated with angiotensinogen at pH 7.2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 2nMpH: 7.2Assay Description:In vitro inhibition of purified Human kidney renin (250 pg/mL) incubated with angiotensinogen at pH 7.2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 0.400nMAssay Description:In vitro inhibition of Human kideny reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Ciba-Geigy

Curated by ChEMBL
LigandPNGBDBM50022582(Diastereomer-5-[2-[2-Benzyl-3-(2-methyl-propane-2-...)
Affinity DataIC50: 1nMAssay Description:In vitro inhibition of marmoset plasma reninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed