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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50107447   
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))		BDBM50107447
PNG
(2-(1-Carbamimidoyl-piperidin-4-yl)-N-{(S)-1-[(S)-3...)
Show SMILES NC(=N)N1CCC(CC(=O)NC[C@@H]2CCCN2C(=O)[C@H](CO)NS(=O)(=O)c2ccc3ccccc3c2)CC1
Show InChI InChI=1S/C26H36N6O5S/c27-26(28)31-12-9-18(10-13-31)14-24(34)29-16-21-6-3-11-32(21)25(35)23(17-33)30-38(36,37)22-8-7-19-4-1-2-5-20(19)15-22/h1-2,4-5,7-8,15,18,21,23,30,33H,3,6,9-14,16-17H2,(H3,27,28)(H,29,34)/t21-,23-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 200n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro inhibition of human thrombin catalytic activity after 3 min pre incubation.

Bioorg Med Chem Lett 12: 41-4 (2001)


BindingDB Entry DOI: 10.7270/Q2MP53T0
More data for this
Ligand-Target Pair