BDBM213220 N-[(3S)-1-Acryloyl-3-pyrrolidinyl]-4-{[cis-2,6-dimethyl-4-morpholinyl]methyl}-N'-[1,3]thiazolo[5,4-b]pyridin-2-yl-2,6-pyridinediamine (9)

SMILES: C[C@H]1CN(Cc2cc(N[C@H]3CCN(C3)C(=O)C=C)nc(Nc3nc4cccnc4s3)c2)C[C@@H](C)O1

InChI Key: InChIKey=QUZOSUHDRJIKQK-SCTDSRPQSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 213220   

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
Interlukin-2-inducible tyrosine kinase (Itk) (Homo sapiens (Human))	BDBM213220 (N-[(3S)-1-Acryloyl-3-pyrrolidinyl]-4-{[cis-2,6-dim...) Show SMILES C[C@H]1CN(Cc2cc(N[C@H]3CCN(C3)C(=O)C=C)nc(Nc3nc4cccnc4s3)c2)C[C@@H](C)O1 |r| Show InChI InChI=1S/C25H31N7O2S/c1-4-23(33)32-9-7-19(15-32)27-21-10-18(14-31-12-16(2)34-17(3)13-31)11-22(29-21)30-25-28-20-6-5-8-26-24(20)35-25/h4-6,8,10-11,16-17,19H,1,7,9,12-15H2,2-3H3,(H2,27,28,29,30)/t16-,17+,19-/m0/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	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