Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase BTK' and Ligand = 'BDBM143203'   

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))	BDBM143203 (US11040980, Example 22 | US8940744, 22 | US9266895...) Show SMILES CC(C)(C)N1CCN(CC1)C(C)(C)C=C(C#N)C(=O)N1CCC[C@H](C1)n1nc(-c2ccc(Oc3ccccc3)cc2F)c2c(N)ncnc12 |r,w:13.13| Show InChI InChI=1S/C37H44FN9O2/c1-36(2,3)45-16-18-46(19-17-45)37(4,5)21-25(22-39)35(48)44-15-9-10-26(23-44)47-34-31(33(40)41-24-42-34)32(43-47)29-14-13-28(20-30(29)38)49-27-11-7-6-8-12-27/h6-8,11-14,20-21,24,26H,9-10,15-19,23H2,1-5H3,(H2,40,41,42)/t26-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.600	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 US8940744 (2015) BindingDB Entry DOI: 10.7270/Q2348J3X
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM143203 (US11040980, Example 22 | US8940744, 22 | US9266895...) Show SMILES CC(C)(C)N1CCN(CC1)C(C)(C)C=C(C#N)C(=O)N1CCC[C@H](C1)n1nc(-c2ccc(Oc3ccccc3)cc2F)c2c(N)ncnc12 |r,w:13.13| Show InChI InChI=1S/C37H44FN9O2/c1-36(2,3)45-16-18-46(19-17-45)37(4,5)21-25(22-39)35(48)44-15-9-10-26(23-44)47-34-31(33(40)41-24-42-34)32(43-47)29-14-13-28(20-30(29)38)49-27-11-7-6-8-12-27/h6-8,11-14,20-21,24,26H,9-10,15-19,23H2,1-5H3,(H2,40,41,42)/t26-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
TBA					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...				Citation and Details BindingDB Entry DOI: 10.7270/Q2KD2212
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM143203 (US11040980, Example 22 | US8940744, 22 | US9266895...) Show SMILES CC(C)(C)N1CCN(CC1)C(C)(C)C=C(C#N)C(=O)N1CCC[C@H](C1)n1nc(-c2ccc(Oc3ccccc3)cc2F)c2c(N)ncnc12 |r,w:13.13| Show InChI InChI=1S/C37H44FN9O2/c1-36(2,3)45-16-18-46(19-17-45)37(4,5)21-25(22-39)35(48)44-15-9-10-26(23-44)47-34-31(33(40)41-24-42-34)32(43-47)29-14-13-28(20-30(29)38)49-27-11-7-6-8-12-27/h6-8,11-14,20-21,24,26H,9-10,15-19,23H2,1-5H3,(H2,40,41,42)/t26-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Genentech					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...				J Med Chem 52: 3300-7 (2009) BindingDB Entry DOI: 10.7270/Q2057J86
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM143203 (US11040980, Example 22 | US8940744, 22 | US9266895...) Show SMILES CC(C)(C)N1CCN(CC1)C(C)(C)C=C(C#N)C(=O)N1CCC[C@H](C1)n1nc(-c2ccc(Oc3ccccc3)cc2F)c2c(N)ncnc12 |r,w:13.13| Show InChI InChI=1S/C37H44FN9O2/c1-36(2,3)45-16-18-46(19-17-45)37(4,5)21-25(22-39)35(48)44-15-9-10-26(23-44)47-34-31(33(40)41-24-42-34)32(43-47)29-14-13-28(20-30(29)38)49-27-11-7-6-8-12-27/h6-8,11-14,20-21,24,26H,9-10,15-19,23H2,1-5H3,(H2,40,41,42)/t26-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.600	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 US9266895 (2016) BindingDB Entry DOI: 10.7270/Q2WD3ZDX
					More data for this Ligand-Target Pair