BDBM50511167 CHEMBL4563187

SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccnc(N)c1

InChI Key InChIKey=GEJSXHIYLBBIKS-LWPKXAGOSA-N

Data  1 KI  2 Kd

  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 = 50511167   

TargetProthrombin(Homo sapiens (Human))
Philipps-University Marburg

Curated by ChEMBL
LigandPNGBDBM50511167(CHEMBL4563187)
Affinity DataKi:  379nMAssay Description:Inhibition of human alpha-thrombin using varying levels of Tos-Gly-Pro-Arg-AMC-TFA as substrate by fluorescence based Michaelis-Menten equation analy...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetSerine protease 1(Bos taurus (bovine))
Philipps-University Marburg

Curated by ChEMBL
LigandPNGBDBM50511167(CHEMBL4563187)
Affinity DataKd:  38nMAssay Description:Binding affinity to bovine beta-trypsin in phosphate/HEPES/Tricine/Tris buffer by ITC methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Philipps-University Marburg

Curated by ChEMBL
LigandPNGBDBM50511167(CHEMBL4563187)
Affinity DataKd:  916nMAssay Description:Binding affinity to human alpha-thrombin in phosphate/HEPES/Tricine/Tris buffer by ITC methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed