Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase BTK' and Ligand = 'BDBM174761'   

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))	BDBM174761 (US9688676, 49 (R)-2-(3-(4-amino-2-oxo-3-(4-phenoxy...) Show SMILES CN1CCN(CC1)C(=O)C(C)(C)C=C(C#N)C(=O)N1CCC[C@H](C1)n1c2ccnc(N)c2n(-c2ccc(Oc3c(F)cccc3F)cc2)c1=O |r,w:12.12| Show InChI InChI=1S/C36H38F2N8O4/c1-36(2,34(48)43-18-16-42(3)17-19-43)20-23(21-39)33(47)44-15-5-6-25(22-44)45-29-13-14-41-32(40)30(29)46(35(45)49)24-9-11-26(12-10-24)50-31-27(37)7-4-8-28(31)38/h4,7-14,20,25H,5-6,15-19,22H2,1-3H3,(H2,40,41)/t25-/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	13	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 the pre...				US Patent US9688676 (2017) BindingDB Entry DOI: 10.7270/Q2XD0ZVX
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