BDBM50431641 CHEMBL490277

SMILES: Clc1ccc2c(Nc3cc(NC(=O)CN4CCCCC4)cc(c3)C(=O)N3CCOCC3)ccnc2c1

InChI Key: InChIKey=QSHFINCERLJELW-UHFFFAOYSA-N

Data: 1 Kd

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50431641   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Heparanase (Homo sapiens (Human))	BDBM50431641 (CHEMBL490277) Show SMILES Clc1ccc2c(Nc3cc(NC(=O)CN4CCCCC4)cc(c3)C(=O)N3CCOCC3)ccnc2c1 Show InChI InChI=1S/C27H30ClN5O3/c28-20-4-5-23-24(6-7-29-25(23)16-20)30-21-14-19(27(35)33-10-12-36-13-11-33)15-22(17-21)31-26(34)18-32-8-2-1-3-9-32/h4-7,14-17H,1-3,8-13,18H2,(H,29,30)(H,31,34)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/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