Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ITK/TSK' and Ligand = 'BDBM50320973'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50320973 (2-(4-Phenyl-1H-pyrazol-3-yl)-1H-indole-6-carboxyli...) Show SMILES COCCNC(=O)c1ccc2cc([nH]c2c1)-c1n[nH]cc1-c1ccccc1 Show InChI InChI=1S/C21H20N4O2/c1-27-10-9-22-21(26)16-8-7-15-11-19(24-18(15)12-16)20-17(13-23-25-20)14-5-3-2-4-6-14/h2-8,11-13,24H,9-10H2,1H3,(H,22,26)(H,23,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nycomed Pharma Pvt. Ltd Curated by ChEMBL					Assay Description Inhibition of GST-tagged full length recombinant ITK after 2 hrs by IMAP assay				Bioorg Med Chem 18: 4547-59 (2010) Article DOI: 10.1016/j.bmc.2010.04.056 BindingDB Entry DOI: 10.7270/Q2N29X4K
					More data for this Ligand-Target Pair