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Found 1 hit Enz. Inhib. hit(s) with Target = 'Heparanase' and Ligand = 'BDBM50466626'   
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))		BDBM50466626
PNG
(CHEMBL4289864)
Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)Cc1ccc2[nH]c(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NC(Cc4ccccc4)C(O)=O)ccc3[nH]2)c(F)c1
Show InChI InChI=1S/C49H40F2N8O7/c50-33-25-31(45-54-37-15-11-29(21-39(37)56-45)23-43(60)52-41(47(62)63)19-27-7-3-1-4-8-27)13-17-35(33)58-49(66)59-36-18-14-32(26-34(36)51)46-55-38-16-12-30(22-40(38)57-46)24-44(61)53-42(48(64)65)20-28-9-5-2-6-10-28/h1-18,21-22,25-26,41-42H,19-20,23-24H2,(H,52,60)(H,53,61)(H,54,56)(H,55,57)(H,62,63)(H,64,65)(H2,58,59,66)
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n/an/a 820n/an/an/an/an/an/a



"Sapienza" Universit£ di Roma

Curated by ChEMBL


Assay Description
Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay

J Med Chem 61: 10834-10859 (2018)


Article DOI: 10.1021/acs.jmedchem.8b01497
BindingDB Entry DOI: 10.7270/Q29K4DWD
More data for this
Ligand-Target Pair