BDBM50355210 CHEMBL1835715

SMILES: [#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8]-[#6]-[#6@@H]-3-[#6@@H](-[#8]-c4c-3cc(-[#6])c(-[#8])c4-[#6]\[#6]=[#6](\[#6])-[#6])-c12

InChI Key: InChIKey=KDEQNCVCQDEWGJ-CCLHPLFOSA-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 = 50355210   

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)	BDBM50355210 (CHEMBL1835715) Show SMILES [#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8]-[#6]-[#6@@H]-3-[#6@@H](-[#8]-c4c-3cc(-[#6])c(-[#8])c4-[#6]\[#6]=[#6](\[#6])-[#6])-c12 |r| Show InChI InChI=1S/C27H32O5/c1-14(2)7-9-17-21(28)12-22-23(26(17)30-6)27-20(13-31-22)19-11-16(5)24(29)18(25(19)32-27)10-8-15(3)4/h7-8,11-12,20,27-29H,9-10,13H2,1-6H3/t20-,27+/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Gyeongsang National University Curated by ChEMBL					Assay Description Non-competitive inhibition of Clostridium perfringens neuraminidase using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate by Linewe...				Bioorg Med Chem Lett 21: 6100-3 (2011) Article DOI: 10.1016/j.bmcl.2011.08.046 BindingDB Entry DOI: 10.7270/Q2C53M8X
					More data for this Ligand-Target Pair
Sialidase (Clostridium perfringens)	BDBM50355210 (CHEMBL1835715) Show SMILES [#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8]-[#6]-[#6@@H]-3-[#6@@H](-[#8]-c4c-3cc(-[#6])c(-[#8])c4-[#6]\[#6]=[#6](\[#6])-[#6])-c12 |r| Show InChI InChI=1S/C27H32O5/c1-14(2)7-9-17-21(28)12-22-23(26(17)30-6)27-20(13-31-22)19-11-16(5)24(29)18(25(19)32-27)10-8-15(3)4/h7-8,11-12,20,27-29H,9-10,13H2,1-6H3/t20-,27+/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Gyeongsang National University Curated by ChEMBL					Assay Description Inhibition of Clostridium perfringens neuraminidase using 4-methylumbelliferyl-alpha-D-N-acetylneuraminic acid as substrate by fluorometry				Bioorg Med Chem Lett 21: 6100-3 (2011) Article DOI: 10.1016/j.bmcl.2011.08.046 BindingDB Entry DOI: 10.7270/Q2C53M8X
					More data for this Ligand-Target Pair