Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase BTK' and Ligand = 'BDBM197186'   

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 BTK (Homo sapiens (Human))	BDBM197186 (US9090621, 32A) Show SMILES Nc1ncnc2n(C[C@H]3CCCN3C(=O)C(=CC3CC3)C#N)nc(-c3ccc(Oc4c(F)cccc4F)cc3)c12 |r,w:16.17| Show InChI InChI=1S/C29H25F2N7O2/c30-22-4-1-5-23(31)26(22)40-21-10-8-18(9-11-21)25-24-27(33)34-16-35-28(24)38(36-25)15-20-3-2-12-37(20)29(39)19(14-32)13-17-6-7-17/h1,4-5,8-11,13,16-17,20H,2-3,6-7,12,15H2,(H2,33,34,35)/t20-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	25
Principia Biopharma Inc. US Patent					Assay Description A Caliper-based kinase assay (Caliper Life Sciences, Hopkinton, Mass.) was used to measure inhibition of Btk kinase activity of a compound of Formula...				US Patent US9090621 (2015) BindingDB Entry DOI: 10.7270/Q27M06QW
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