BDBM50307861 (S)-1-butyryl-N-(4-carbamimidoylbenzyl)pyrrolidine-2-carboxamide hydrochloride::CHEMBL598213

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

InChI Key InChIKey=RYAZZWWVNUWKNB-AWEZNQCLSA-N

Data  3 KI

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50307861   

TargetProthrombin(Human)
The State University of New York

Curated by ChEMBL
LigandPNGBDBM50307861((S)-1-butyryl-N-(4-carbamimidoylbenzyl)pyrrolidine...)
Affinity DataKi:  5.00E+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 DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetProthrombin(Human)
The State University of New York

Curated by ChEMBL
LigandPNGBDBM50307861((S)-1-butyryl-N-(4-carbamimidoylbenzyl)pyrrolidine...)
Affinity DataKi:  5.00E+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 DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetProthrombin(Human)
The State University of New York

Curated by ChEMBL
LigandPNGBDBM50307861((S)-1-butyryl-N-(4-carbamimidoylbenzyl)pyrrolidine...)
Affinity DataKi:  5.70E+3nMAssay Description:Binding affinity to human thrombin by standard kinetic photometric assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)