null
SMILES: CN1CCC(CC1)Oc1ccc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccccn23)cc1C(F)(F)F
InChI Key: InChIKey=CQKLZUWHJYAEJS-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tyrosine-protein kinase ABL1 (Homo sapiens (Human)) | BDBM50322549 (3-[2-(Imidazo[1,2-a]pyridin-3-yl)ethynyl]-4-methyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 9.10 | n/a | n/a | n/a | n/a | n/a | n/a |
ARIAD Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of wild type human ABL after 1 hr by TR-FRET assay | J Med Chem 53: 4701-19 (2010) Article DOI: 10.1021/jm100395q BindingDB Entry DOI: 10.7270/Q27P8ZKX | |||||||||||
More data for this Ligand-Target Pair |