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Found 1 hit Enz. Inhib. hit(s) with Target = 'Heparanase' and Ligand = 'BDBM50431646'   
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
Heparanase


(Homo sapiens (Human))		BDBM50431646
PNG
(CHEMBL330684)
Show SMILES OCc1cc(NC(=O)CN2CCOCC2)cc(Nc2ccnc3cc(Cl)ccc23)c1
Show InChI InChI=1S/C22H23ClN4O3/c23-16-1-2-19-20(3-4-24-21(19)11-16)25-17-9-15(14-28)10-18(12-17)26-22(29)13-27-5-7-30-8-6-27/h1-4,9-12,28H,5-8,13-14H2,(H,24,25)(H,26,29)
PDB

KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 7.50E+4n/an/an/an/an/a



Structural Biochemistry Laboratory, Centro de Investigaci�n Pr�ncipe Felipe, 46012 Valencia, Spain. rgozalbes@cipf.es

Curated by ChEMBL


Assay Description
Binding affinity to recombinant heparanase catalytic stie (unknown origin) expressed in Escherichia coli BL21 (DE3) by surface plasmon resonance assa...

Bioorg Med Chem 21: 1944-51 (2013)


Article DOI: 10.1016/j.bmc.2013.01.033
BindingDB Entry DOI: 10.7270/Q2HQ419G
More data for this
Ligand-Target Pair