Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase BTK' and Ligand = 'BDBM351875'   

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))	BDBM351875 (US9796716, Compound 120) Show SMILES Cc1ncc(COc2cc(F)cc(Oc3ccc(cc3)-c3nn(C4CCCC4)c4ncnc(N)c34)c2)n1C Show InChI InChI=1S/C28H28FN7O2/c1-17-31-14-21(35(17)2)15-37-23-11-19(29)12-24(13-23)38-22-9-7-18(8-10-22)26-25-27(30)32-16-33-28(25)36(34-26)20-5-3-4-6-20/h7-14,16,20H,3-6,15H2,1-2H3,(H2,30,32,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
PHARMASCIENCE, INC. US Patent					Assay Description Fluorescence polarization-based kinase assays were performed in 384 well-plate format using histidine tagged recombinant human full-length Bruton Aga...				US Patent US9796716 (2017) BindingDB Entry DOI: 10.7270/Q2MW2K8J
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