BDBM50274310 CHEMBL451045::p-Methoxyphenyl (3,5,9-trideoxy-9-(4'-trifluromethyl-4-biphenyl)methylamino-5-glycolamido-D-glycero-alpha-D-galacto-2-nonulopyranosylonicacid)-(2->6)-beta-D-galactopyranoside

SMILES: COc1ccc(O[C@@H]2O[C@H](CO[C@@]3(C[C@H](O)[C@@H](NC(=O)CO)[C@@H](O3)[C@H](O)[C@H](O)CNCc3ccc(cc3)-c3ccc(cc3)C(F)(F)F)C(O)=O)[C@H](O)[C@H](O)[C@H]2O)cc1

InChI Key: InChIKey=WOBPUCZIEBDMIU-GFYPMFDPSA-N

Data: 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 1 hit for monomerid = 50274310   

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
CD22 (Homo sapiens (Human))	BDBM50274310 (CHEMBL451045 | p-Methoxyphenyl (3,5,9-trideoxy-9-(...) Show SMILES COc1ccc(O[C@@H]2O[C@H](CO[C@@]3(C[C@H](O)[C@@H](NC(=O)CO)[C@@H](O3)[C@H](O)[C@H](O)CNCc3ccc(cc3)-c3ccc(cc3)C(F)(F)F)C(O)=O)[C@H](O)[C@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C38H45F3N2O15/c1-54-23-10-12-24(13-11-23)56-35-33(51)32(50)31(49)27(57-35)18-55-37(36(52)53)14-25(45)29(43-28(47)17-44)34(58-37)30(48)26(46)16-42-15-19-2-4-20(5-3-19)21-6-8-22(9-7-21)38(39,40)41/h2-13,25-27,29-35,42,44-46,48-51H,14-18H2,1H3,(H,43,47)(H,52,53)/t25-,26+,27+,29+,30+,31-,32-,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	4.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Gifu University Curated by ChEMBL					Assay Description Binding affinity to biotinylated human CD22-human IgG1 chimeric protein expressed in mouse J558LST6 cells by flow cytometry				J Med Chem 51: 6665-81 (2008) Article DOI: 10.1021/jm8000696 BindingDB Entry DOI: 10.7270/Q23X86GN
					More data for this Ligand-Target Pair