null
SMILES: CCOC(=O)[C@@H](NC(=O)[C@H]1C[C@@H](O)CN1C(=O)CCCC([O-])=O)[C@@H](C)O[C@@H]1O[C@@H](C)[C@@H](O)C(O)C1O
InChI Key: InChIKey=COKKTSOFEKXYJR-ZDDBOOJFSA-M
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
E-selectin (Homo sapiens (Human)) | BDBM50288312 (5-{(2R,4R)-2-[(1S,2R)-1-Ethoxycarbonyl-2-((2R,5S,6...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article | n/a | n/a | 3.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibitory activity against Selectin E | Bioorg Med Chem Lett 6: 2755-2760 (1996) Article DOI: 10.1016/S0960-894X(96)00509-4 BindingDB Entry DOI: 10.7270/Q2CV4J8C | |||||||||||
More data for this Ligand-Target Pair |