null

SMILES: OC[C@H]1O[C@](O)([C@@H](O)[C@@H](O)[C@@H]1O)C(F)(F)C(=O)N[C@@H](CCC(O)=O)C(O)=O

InChI Key: InChIKey=CWCBUFOYNNYNKN-ZPGBPUSPSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50313786   

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
P-selectin (Homo sapiens (Human))	BDBM50313786 ((S)-2-(2,2-difluoro-2-((2R,3S,4S,5S,6R)-2,3,4,5-te...) Show SMILES OC[C@H]1O[C@](O)([C@@H](O)[C@@H](O)[C@@H]1O)C(F)(F)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H19F2NO11/c14-12(15,11(25)16-4(10(23)24)1-2-6(18)19)13(26)9(22)8(21)7(20)5(3-17)27-13/h4-5,7-9,17,20-22,26H,1-3H2,(H,16,25)(H,18,19)(H,23,24)/t4-,5+,7+,8-,9-,13+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+7	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ et INSA de Rouen Curated by ChEMBL					Assay Description Inhibition of human recombinant P-Selectin assessed as inhibition of binding of HL-60 cells expressing tetrasaccharide sialyl Lewis x to selectin coa...				Bioorg Med Chem Lett 20: 1957-60 (2010) Article DOI: 10.1016/j.bmcl.2010.01.141 BindingDB Entry DOI: 10.7270/Q22Z15P9
					More data for this Ligand-Target Pair
E-selectin (Homo sapiens (Human))	BDBM50313786 ((S)-2-(2,2-difluoro-2-((2R,3S,4S,5S,6R)-2,3,4,5-te...) Show SMILES OC[C@H]1O[C@](O)([C@@H](O)[C@@H](O)[C@@H]1O)C(F)(F)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r| Show InChI InChI=1S/C13H19F2NO11/c14-12(15,11(25)16-4(10(23)24)1-2-6(18)19)13(26)9(22)8(21)7(20)5(3-17)27-13/h4-5,7-9,17,20-22,26H,1-3H2,(H,16,25)(H,18,19)(H,23,24)/t4-,5+,7+,8-,9-,13+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+7	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ et INSA de Rouen Curated by ChEMBL					Assay Description Inhibition of human recombinant E-Selectin assessed as inhibition of binding of HL-60 cells expressing tetrasaccharide sialyl Lewis x to selectin coa...				Bioorg Med Chem Lett 20: 1957-60 (2010) Article DOI: 10.1016/j.bmcl.2010.01.141 BindingDB Entry DOI: 10.7270/Q22Z15P9
					More data for this Ligand-Target Pair