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SMILES: Cc1cc(OCCCONC(N)=N)cc(c1)C(=O)N(CC1CC1)Cc1ccsc1

InChI Key: InChIKey=WFPRNZORFKQBGH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50149012   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Prothrombin


(Homo sapiens (Human))		BDBM50149012
PNG
(CHEMBL333182 | Oxyguanidine derivative)
Show SMILES Cc1cc(OCCCONC(N)=N)cc(c1)C(=O)N(CC1CC1)Cc1ccsc1
Show InChI InChI=1S/C21H28N4O3S/c1-15-9-18(11-19(10-15)27-6-2-7-28-24-21(22)23)20(26)25(12-16-3-4-16)13-17-5-8-29-14-17/h5,8-11,14,16H,2-4,6-7,12-13H2,1H3,(H4,22,23,24)
PDB

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antibodypedia
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Similars
Article
PubMed
 31n/an/an/an/an/an/an/an/a



3-Dimensional Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against thrombin

Bioorg Med Chem Lett 14: 3727-31 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.002
BindingDB Entry DOI: 10.7270/Q2D79C0Q
More data for this
Ligand-Target Pair