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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50107464   
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))		BDBM50107464
PNG
((R)-5-[(S)-2-(4-Guanidino-butylcarbamoyl)-pyrrolid...)
Show SMILES NC(=N)NCCCCNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCC(O)=O)NS(=O)(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C25H34N6O6S/c26-25(27)29-14-4-3-13-28-23(34)21-8-5-15-31(21)24(35)20(11-12-22(32)33)30-38(36,37)19-10-9-17-6-1-2-7-18(17)16-19/h1-2,6-7,9-10,16,20-21,30H,3-5,8,11-15H2,(H,28,34)(H,32,33)(H4,26,27,29)/t20-,21+/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a>3.33E+5n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against hydrolysis of human alpha thrombin

Bioorg Med Chem Lett 12: 45-9 (2001)


BindingDB Entry DOI: 10.7270/Q2GX4C3P
More data for this
Ligand-Target Pair