BDBM50442395 CHEMBL2442951

SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c2-[#8]C([#6])([#6])[#6]=[#6]-c2cc1-c1coc2cc(-[#8])cc(-[#8])c2c1=O

InChI Key: InChIKey=MXRSYAGBZPTIHM-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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 2 hits for monomerid = 50442395   

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
Sialidase (Clostridium perfringens)	BDBM50442395 (CHEMBL2442951) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c2-[#8]C([#6])([#6])[#6]=[#6]-c2cc1-c1coc2cc(-[#8])cc(-[#8])c2c1=O |c:13| Show InChI InChI=1S/C25H24O6/c1-13(2)5-6-16-17(9-14-7-8-25(3,4)31-24(14)23(16)29)18-12-30-20-11-15(26)10-19(27)21(20)22(18)28/h5,7-12,26-27,29H,6H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Graduate School of Gyeongsang National University Curated by ChEMBL					Assay Description Non-competitive inhibition of Clostridium perfringens neuraminidase using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid sodium salt hydrate as...				Bioorg Med Chem 21: 6398-404 (2013) Article DOI: 10.1016/j.bmc.2013.08.049 BindingDB Entry DOI: 10.7270/Q2Z89DVN
					More data for this Ligand-Target Pair
Sialidase (Clostridium perfringens)	BDBM50442395 (CHEMBL2442951) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c2-[#8]C([#6])([#6])[#6]=[#6]-c2cc1-c1coc2cc(-[#8])cc(-[#8])c2c1=O |c:13| Show InChI InChI=1S/C25H24O6/c1-13(2)5-6-16-17(9-14-7-8-25(3,4)31-24(14)23(16)29)18-12-30-20-11-15(26)10-19(27)21(20)22(18)28/h5,7-12,26-27,29H,6H2,1-4H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.68E+4	n/a	n/a	n/a	n/a	n/a	n/a
Graduate School of Gyeongsang National University Curated by ChEMBL					Assay Description Inhibition of Clostridium perfringens neuraminidase using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid sodium salt hydrate as substrate by fl...				Bioorg Med Chem 21: 6398-404 (2013) Article DOI: 10.1016/j.bmc.2013.08.049 BindingDB Entry DOI: 10.7270/Q2Z89DVN
					More data for this Ligand-Target Pair