BDBM50050454 CHEMBL177789::O-(3-O-Sulfo-beta-D-galactopyranosyl)-(1-4)-O-[alpha-L-fucopyransyl-(1-3-)]-2-acetamido-1,5-anhydro-D-glucitol sodium salt
SMILES: C[C@@H]1O[C@@H](O[C@@H]2[C@H](CO[C@H](CO)[C@H]2O[C@@H]2O[C@H](O)[C@H](OS([O-])(=O)=O)[C@H](O)[C@H]2O)NC(C)=O)[C@@H](O)[C@H](O)[C@@H]1O
InChI Key: InChIKey=VRDOIXAVAPYCRP-YBLIIIFGSA-M
Data: 3 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Selectin E (Homo sapiens (Human)) | BDBM50050454 (CHEMBL177789 | O-(3-O-Sulfo-beta-D-galactopyranosy...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research Laboratories Curated by ChEMBL | Assay Description Inhibitory activity against human chimeric E-selectin-Ig | J Med Chem 39: 1339-43 (1996) Article DOI: 10.1021/jm9506478 BindingDB Entry DOI: 10.7270/Q2513ZWW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Leukocyte adhesion molecule-1 (Homo sapiens (Human)) | BDBM50050454 (CHEMBL177789 | O-(3-O-Sulfo-beta-D-galactopyranosy...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research Laboratories Curated by ChEMBL | Assay Description Inhibitory activity against human chimeric L-selectin-Ig | J Med Chem 39: 1339-43 (1996) Article DOI: 10.1021/jm9506478 BindingDB Entry DOI: 10.7270/Q2513ZWW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P-selectin/P-selectin glycoprotein ligand 1 (Homo sapiens (Human)) | BDBM50050454 (CHEMBL177789 | O-(3-O-Sulfo-beta-D-galactopyranosy...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Cancer Research Laboratories Curated by ChEMBL | Assay Description Inhibitory activity against human chimeric Selectin P-Ig | J Med Chem 39: 1339-43 (1996) Article DOI: 10.1021/jm9506478 BindingDB Entry DOI: 10.7270/Q2513ZWW | |||||||||||
More data for this Ligand-Target Pair |