BDBM50265149 (E)-1-morpholino-3-(4-(2-(tetrahydro-2H-pyran-4-yloxy)phenylthio)-2,3-bis(trifluoromethyl)phenyl)prop-2-en-1-one::CHEMBL497978
SMILES: FC(F)(F)c1c(Sc2ccccc2OC2CCOCC2)ccc(\C=C\C(=O)N2CCOCC2)c1C(F)(F)F
InChI Key: InChIKey=VQFPBCXPBVPOKI-SOFGYWHQSA-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 |
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Integrin alpha-L/beta-2 (LFA-1) (Homo sapiens (Human)) | BDBM50265149 ((E)-1-morpholino-3-(4-(2-(tetrahydro-2H-pyran-4-yl...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Biogen Idec Inc. Curated by ChEMBL | Assay Description Inhibition of recombinant LFA1/ICAM1-IG interaction (unknown origin) by time-resolved fluorimetry method | Bioorg Med Chem Lett 18: 5245-8 (2008) Article DOI: 10.1016/j.bmcl.2008.08.062 BindingDB Entry DOI: 10.7270/Q23B5ZZ1 | |||||||||||
More data for this Ligand-Target Pair |