BDBM50046798 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-thiazol-4-yl-ethyl]-3-(4-methyl-piperazine-1-sulfonyl)-propionamide::2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-thiazol-4-yl-ethyl]-3-(4-methyl-piperazine-1-sulfonyl)-propionamide (Zankiren (A-72517))::A-72517::CHEMBL113841::zankiren

SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cscn1)NC(=O)[C@H](Cc1ccccc1)CS(=O)(=O)N1CCN(C)CC1

InChI Key InChIKey=YFDSDRDMDDGDFC-UHFFFAOYSA-N

Data  7 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 7 hits for monomerid = 50046798   

TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046798(zankiren | 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-d...)
Affinity DataIC50: 0.240nMpH: 7.4Assay Description:In vitro inhibitory concentration against monkey plasma renin at pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046798(zankiren | 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-d...)
Affinity DataIC50: 110nMpH: 7.4Assay Description:In vitro inhibitory concentration against dog plasma renin at pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046798(zankiren | 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-d...)
Affinity DataIC50: 1.10nMpH: 7.4Assay Description:In vitro inhibitory concentration against human plasma renin at pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Rat)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046798(zankiren | 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-d...)
Affinity DataIC50: 1.40E+3nMpH: 7.4Assay Description:In vitro inhibitory concentration against rat plasma renin at pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046798(zankiren | 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-d...)
Affinity DataIC50: 1.10nMpH: 7.4Assay Description:In vitro inhibitory concentration against human plasma renin at pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046798(zankiren | 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-d...)
Affinity DataIC50: 1.10nMAssay Description:Inhibition activity against human plasma renin at pH=7.4.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/25/2012
Entry Details Article
PubMed
TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046798(zankiren | 2-Benzyl-N-[1-(1-cyclohexylmethyl-2,3-d...)
Affinity DataIC50: 1.10nMAssay Description:Inhibition of human recombinant rennin in human plasma assessed as accumulation of angiotensin 1 using human tetradecapeptide by immunoassayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/23/2012
Entry Details Article
PubMed