BDBM50338747 (4-Biphenyl)methyl 3,5,9-trideoxy-5-glycolamido-9-(4'-hydroxy-4-biphenyl)methylamino-D-glycero-alpha-D-galacto-2-nonulopyranosidonic acid::CHEMBL1684364

SMILES: OCC(=O)N[C@@H]1[C@@H](O)C[C@@](OCc2ccc(cc2)-c2ccccc2)(O[C@H]1[C@H](O)[C@H](O)CNCc1ccc(cc1)-c1ccc(O)cc1)C(O)=O

InChI Key: InChIKey=MVHCWEQZCXSHJH-BGJYJLNOSA-N

Data: 3 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 3 hits for monomerid = 50338747   

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
B-cell receptor CD22 (Mus musculus)	BDBM50338747 ((4-Biphenyl)methyl 3,5,9-trideoxy-5-glycolamido-9-...) Show SMILES OCC(=O)N[C@@H]1[C@@H](O)C[C@@](OCc2ccc(cc2)-c2ccccc2)(O[C@H]1[C@H](O)[C@H](O)CNCc1ccc(cc1)-c1ccc(O)cc1)C(O)=O |r| Show InChI InChI=1S/C37H40N2O10/c40-21-32(44)39-33-30(42)18-37(36(46)47,48-22-24-8-12-26(13-9-24)25-4-2-1-3-5-25)49-35(33)34(45)31(43)20-38-19-23-6-10-27(11-7-23)28-14-16-29(41)17-15-28/h1-17,30-31,33-35,38,40-43,45H,18-22H2,(H,39,44)(H,46,47)/t30-,31+,33+,34+,35+,37+/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gifu University Curated by ChEMBL					Assay Description Antagonist activity at mouse CD22 after 1 hr by competitive ELISA				Bioorg Med Chem 19: 1966-71 (2011) Article DOI: 10.1016/j.bmc.2011.01.060 BindingDB Entry DOI: 10.7270/Q2QZ2B7T
					More data for this Ligand-Target Pair
Myelin-associated glycoprotein (Homo sapiens (Human))	BDBM50338747 ((4-Biphenyl)methyl 3,5,9-trideoxy-5-glycolamido-9-...) Show SMILES OCC(=O)N[C@@H]1[C@@H](O)C[C@@](OCc2ccc(cc2)-c2ccccc2)(O[C@H]1[C@H](O)[C@H](O)CNCc1ccc(cc1)-c1ccc(O)cc1)C(O)=O |r| Show InChI InChI=1S/C37H40N2O10/c40-21-32(44)39-33-30(42)18-37(36(46)47,48-22-24-8-12-26(13-9-24)25-4-2-1-3-5-25)49-35(33)34(45)31(43)20-38-19-23-6-10-27(11-7-23)28-14-16-29(41)17-15-28/h1-17,30-31,33-35,38,40-43,45H,18-22H2,(H,39,44)(H,46,47)/t30-,31+,33+,34+,35+,37+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gifu University Curated by ChEMBL					Assay Description Inhibition of human MAG after 1 hr by competitive ELISA				Bioorg Med Chem 19: 1966-71 (2011) Article DOI: 10.1016/j.bmc.2011.01.060 BindingDB Entry DOI: 10.7270/Q2QZ2B7T
					More data for this Ligand-Target Pair
CD22 (Homo sapiens (Human))	BDBM50338747 ((4-Biphenyl)methyl 3,5,9-trideoxy-5-glycolamido-9-...) Show SMILES OCC(=O)N[C@@H]1[C@@H](O)C[C@@](OCc2ccc(cc2)-c2ccccc2)(O[C@H]1[C@H](O)[C@H](O)CNCc1ccc(cc1)-c1ccc(O)cc1)C(O)=O |r| Show InChI InChI=1S/C37H40N2O10/c40-21-32(44)39-33-30(42)18-37(36(46)47,48-22-24-8-12-26(13-9-24)25-4-2-1-3-5-25)49-35(33)34(45)31(43)20-38-19-23-6-10-27(11-7-23)28-14-16-29(41)17-15-28/h1-17,30-31,33-35,38,40-43,45H,18-22H2,(H,39,44)(H,46,47)/t30-,31+,33+,34+,35+,37+/m0/s1	PDB NCI pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gifu University Curated by ChEMBL					Assay Description Antagonist activity at human CD22 after 1 hr by competitive ELISA				Bioorg Med Chem 19: 1966-71 (2011) Article DOI: 10.1016/j.bmc.2011.01.060 BindingDB Entry DOI: 10.7270/Q2QZ2B7T
					More data for this Ligand-Target Pair