BDBM50026886 CHEMBL3335532
SMILES: COC(=O)[C@H](O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](OC(=O)c2ccccc2)[C@H](O[C@H](Cc2ccccc2)C(O)=O)[C@H]1OC(=O)c1ccccc1)C(=O)OC(C)C
InChI Key: InChIKey=NTUAWEYPTJBGPL-VRHNUPIHSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
P-selectin/P-selectin glycoprotein ligand 1 (Homo sapiens (Human)) | BDBM50026886 (CHEMBL3335532) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institut de Recherches Cliniques de Montr£al (IRCM) Curated by ChEMBL | Assay Description Antagonist activity at P-selectin (unknown origin) by surface plasmon resonance-based dynamic assay | ACS Med Chem Lett 5: 1054-9 (2014) Article DOI: 10.1021/ml500266x BindingDB Entry DOI: 10.7270/Q2KW5HNG | |||||||||||
More data for this Ligand-Target Pair |