BDBM50131465 (S)-21-Benzyl-8,26-dichloro-12,17-dioxa-1,4,19,22,24-pentaaza-tricyclo[21.3.1.0*6,11*]heptacosa-6(11),7,9,23,25-pentaene-3,18,27-trione::CHEMBL94413

SMILES Clc1ccc2OCCCCOC(=O)NC[C@H](Cc3ccccc3)Nc3ncc(Cl)n(CC(=O)NCc2c1)c3=O

InChI Key InChIKey=OKJSQHIVLJMGND-UHFFFAOYSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50131465   

TargetProthrombin(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50131465((S)-21-Benzyl-8,26-dichloro-12,17-dioxa-1,4,19,22,...)
Affinity DataKi:  0.630nMAssay Description:Inhibitory activity against thrombin IIaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/8/2012
Entry Details Article
PubMed
TargetSerine protease 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50131465((S)-21-Benzyl-8,26-dichloro-12,17-dioxa-1,4,19,22,...)
Affinity DataKi:  4.00E+3nMAssay Description:Inhibitory activity against human trypsinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/8/2012
Entry Details Article
PubMed