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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prothrombin' and Ligand = 'BDBM50070502'   
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))		BDBM50070502
PNG
(((R)-1-Benzyl-2-{(R)-2-[(S)-4-guanidino-1-(2-oxo-e...)
Show SMILES CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCNC(N)=N)CC=O
Show InChI InChI=1S/C26H40N6O5/c1-26(2,3)37-25(36)31-20(17-18-9-5-4-6-10-18)23(35)32-15-8-12-21(32)22(34)30-19(13-16-33)11-7-14-29-24(27)28/h4-6,9-10,16,19-21H,7-8,11-15,17H2,1-3H3,(H,30,34)(H,31,36)(H4,27,28,29)/t19-,20+,21+/m0/s1
PDB

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PC sid
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Similars
PubMed
n/an/a 190n/an/an/an/an/an/a



Institute for Drug Research

Curated by ChEMBL


Assay Description
Ability to inhibit Thrombin was evaluated by amidolytic method using fluorogenic or chromogenic substrates

Bioorg Med Chem Lett 8: 1477-82 (1999)

Checked by Author
BindingDB Entry DOI: 10.7270/Q2GB24KF
More data for this
Ligand-Target Pair