BDBM50307862 (S)-N-(4-carbamimidoylbenzyl)-1-(3-methylbutanoyl)pyrrolidine-2-carboxamide hydrochloride::CHEMBL603544

SMILES CC(C)CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(cc1)C(N)=N

InChI Key InChIKey=RHXRIFKSRQZGPE-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 50307862   

TargetProthrombin(Human)
The State University of New York

Curated by ChEMBL
LigandPNGBDBM50307862((S)-N-(4-carbamimidoylbenzyl)-1-(3-methylbutanoyl)...)
Affinity DataKi:  3.50E+3nMAssay Description:Inhibition of human alpha-thrombin using tPa (CH3SO2-D-Cha-Gly-Arg-pNA.AcOH) as chromogenic substrate by kinetic photometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/1/2016
Entry Details Article
PubMed
TargetProthrombin(Human)
The State University of New York

Curated by ChEMBL
LigandPNGBDBM50307862((S)-N-(4-carbamimidoylbenzyl)-1-(3-methylbutanoyl)...)
Affinity DataKi:  3.81E+3nMAssay Description:Binding affinity to human thrombin by standard kinetic photometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2010
Entry Details Article
PubMed
TargetProthrombin(Human)
The State University of New York

Curated by ChEMBL
LigandPNGBDBM50307862((S)-N-(4-carbamimidoylbenzyl)-1-(3-methylbutanoyl)...)
Affinity DataKi:  4.00E+3nMAssay Description:Inhibition of human alpha-thrombin using chromogenic substrate Pefachrome tPa measured every second for 20 mins by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details Article
PubMed