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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thrombin' and Monomerid = 50070625   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thrombin and coagulation factor X


(Homo sapiens (Human))
BDBM50070625
PNG
(CHEMBL40373 | N-[3-(5-Amino-pentyloxy)-5-methyl-ph...)
Show SMILES Cc1cc(NS(=O)(=O)c2ccccc2)cc(OCCCCCN)c1
Show InChI InChI=1S/C18H24N2O3S/c1-15-12-16(14-17(13-15)23-11-7-3-6-10-19)20-24(21,22)18-8-4-2-5-9-18/h2,4-5,8-9,12-14,20H,3,6-7,10-11,19H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9.90E+3n/an/an/an/an/an/an/an/a



Pharmazeutisch-Chemisches Institut der Universität

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin


Bioorg Med Chem Lett 8: 1613-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00269-8
BindingDB Entry DOI: 10.7270/Q2VH5N09
More data for this
Ligand-Target Pair