BDBM50274671 4-cyano-N-(5-(N-methylcyclohexanecarboxamido)-1-(3-(4-methylpiperazin-1-yl)propyl)-1H-benzo[d]imidazol-2-yl)benzamide::CHEMBL523633
SMILES: CN(C(=O)C1CCCCC1)c1ccc2n(CCCN3CCN(C)CC3)c(NC(=O)c3ccc(cc3)C#N)nc2c1
InChI Key: InChIKey=ZPHYAXPSDMTUGL-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tyrosine-protein kinase ITK/TSK (Homo sapiens (Human)) | BDBM50274671 (4-cyano-N-(5-(N-methylcyclohexanecarboxamido)-1-(3...) | PDB MMDB 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 | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Johnson & Johnson Curated by ChEMBL | Assay Description Inhibition of ITK by DELFIA assay | Bioorg Med Chem Lett 18: 5545-9 (2008) Article DOI: 10.1016/j.bmcl.2008.09.015 BindingDB Entry DOI: 10.7270/Q2M32VMD | |||||||||||
More data for this Ligand-Target Pair |