BDBM213218 N2-[(3S)-1-Acryloyl-3-pyrrolidinyl]-6-(4-morpholinylmethyl)-N4-[1,3]thiazolo[5,4-b]pyridin-2-yl-2,4-pyrimidinediamine (7)
SMILES: C=CC(=O)N1CC[C@@H](C1)Nc1nc(CN2CCOCC2)cc(Nc2nc3cccnc3s2)n1
InChI Key: InChIKey=LZANMDGKZJPQIB-HNNXBMFYSA-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 |
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Interlukin-2-inducible tyrosine kinase (Itk) (Homo sapiens (Human)) | BDBM213218 (N2-[(3S)-1-Acryloyl-3-pyrrolidinyl]-6-(4-morpholin...) | PDB GoogleScholar AffyNet | PC cid PC sid PDB UniChem | PDB Article PubMed | n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline | Assay Description This assay is based on the binding and displacement of Alexa-fluor 647-labeled ATP-competitive kinase inhibitor tracer 236. Binding of the tracer is ... | J Biol Chem 288: 28195-206 (2013) Article DOI: 10.1074/jbc.M113.474114 BindingDB Entry DOI: 10.7270/Q2ZW1JSK | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |