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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50106067'   
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
Prothrombin


(Homo sapiens (Human))
BDBM50106067
PNG
((S)-4-(3-Carbamimidoyl-benzoylamino)-4-(2'-sulfamo...)
Show SMILES NC(=N)c1cccc(c1)C(=O)N[C@@H](CCC(O)=O)C(=O)Nc1ccc(cc1)-c1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C25H25N5O6S/c26-23(27)16-4-3-5-17(14-16)24(33)30-20(12-13-22(31)32)25(34)29-18-10-8-15(9-11-18)19-6-1-2-7-21(19)37(28,35)36/h1-11,14,20H,12-13H2,(H3,26,27)(H,29,34)(H,30,33)(H,31,32)(H2,28,35,36)/t20-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



COR Therapeutics, Inc.

Curated by ChEMBL


Assay Description
In vitro inhibition of human thrombin.


Bioorg Med Chem Lett 11: 2947-50 (2001)


BindingDB Entry DOI: 10.7270/Q27H1HW6
More data for this
Ligand-Target Pair