BDBM50050960 CHEMBL7864::Pentacosa-10,12-diynoic acid (2-hydroxy-ethyl)-amide
SMILES: CCCCCCCCCCCCC#CC#CCCCCCCCCC(=O)NCCO
InChI Key: InChIKey=KMKKLXMLBOQSCV-UHFFFAOYSA-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)) | BDBM50050960 (CHEMBL7864 | Pentacosa-10,12-diynoic acid (2-hydro...) | 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 | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Lawrence Berkeley National Laboratories Curated by ChEMBL | Assay Description Inhibitory activity of the compound against Selectin P IgG chimera binding to HL-60 cells, by binding to Selectin P | J Med Chem 39: 1018-20 (1996) Article DOI: 10.1021/jm950914+ BindingDB Entry DOI: 10.7270/Q2JW8D0J | |||||||||||
More data for this Ligand-Target Pair |