Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase BTK/Lck' AND taxid = 9606   

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/Lck (Homo sapiens (Human))	BDBM194087 (US20230364079, Example Tirabrutinib | US9199997, 9...) Show SMILES CC#CC(=O)N1CC[C@H](C1)n1c2ncnc(N)c2n(-c2ccc(Oc3ccccc3)cc2)c1=O |r| Show InChI InChI=1S/C25H22N6O3/c1-2-6-21(32)29-14-13-18(15-29)31-24-22(23(26)27-16-28-24)30(25(31)33)17-9-11-20(12-10-17)34-19-7-4-3-5-8-19/h3-5,7-12,16,18H,13-15H2,1H3,(H2,26,27,28)/t18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	375	n/a	n/a	n/a	n/a	n/a	30
ONO PHARMACEUTICAL CO., LTD. US Patent					Assay Description The measurement of Btk enzyme inhibitory activity was performed using the following reagents: Z'-LYTE Kinase Assay Kit-Tyr 1 (containing Tyr 1 peptid...				US Patent US9199997 (2015) BindingDB Entry DOI: 10.7270/Q2GF0S90
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK/Lck (Homo sapiens (Human))	BDBM275489 (US9879013, 11(3)) Show SMILES CN(C)C\C=C\C(=O)N1CC[C@H](C1)n1c2ncnc(N)c2n(-c2ccc(Oc3ccccc3)cc2)c1=O Show InChI InChI=1S/C27H29N7O3/c1-31(2)15-6-9-23(35)32-16-14-20(17-32)34-26-24(25(28)29-18-30-26)33(27(34)36)19-10-12-22(13-11-19)37-21-7-4-3-5-8-21/h3-13,18,20H,14-17H2,1-2H3,(H2,28,29,30)/b9-6+/t20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
ONO PHARMACEUTICAL CO., LTD. US Patent					Assay Description The Btk enzyme inhibitory activity was measured, based on the protocol provided by the manufacturer, using Btk (Invitrogen Corporation) and the ZR...				US Patent US9879013 (2018) BindingDB Entry DOI: 10.7270/Q2X63PZ1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK/Lck (Homo sapiens (Human))	BDBM275463 (US9879013, 8) Show SMILES Nc1ncnc2n(C3CN(C3)C(=O)C=C)c(=O)n(-c3ccc(Oc4ccccc4)cc3)c12 Show InChI InChI=1S/C23H20N6O3/c1-2-19(30)27-12-16(13-27)29-22-20(21(24)25-14-26-22)28(23(29)31)15-8-10-18(11-9-15)32-17-6-4-3-5-7-17/h2-11,14,16H,1,12-13H2,(H2,24,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
ONO PHARMACEUTICAL CO., LTD. US Patent					Assay Description The Btk enzyme inhibitory activity was measured, based on the protocol provided by the manufacturer, using Btk (Invitrogen Corporation) and the ZR...				US Patent US9879013 (2018) BindingDB Entry DOI: 10.7270/Q2X63PZ1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK/Lck (Homo sapiens (Human))	BDBM194087 (US20230364079, Example Tirabrutinib | US9199997, 9...) Show SMILES CC#CC(=O)N1CC[C@H](C1)n1c2ncnc(N)c2n(-c2ccc(Oc3ccccc3)cc2)c1=O |r| Show InChI InChI=1S/C25H22N6O3/c1-2-6-21(32)29-14-13-18(15-29)31-24-22(23(26)27-16-28-24)30(25(31)33)17-9-11-20(12-10-17)34-19-7-4-3-5-8-19/h3-5,7-12,16,18H,13-15H2,1H3,(H2,26,27,28)/t18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	1.14E+5	n/a	n/a	n/a	n/a	n/a	n/a
ONO PHARMACEUTICAL CO., LTD. US Patent					Assay Description The Btk enzyme inhibitory activity was measured, based on the protocol provided by the manufacturer, using Btk (Invitrogen Corporation) and the ZR...				US Patent US9879013 (2018) BindingDB Entry DOI: 10.7270/Q2X63PZ1
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK/Lck (Homo sapiens (Human))	BDBM275473 (US9879013, 8(14)) Show SMILES Nc1ncnc2n(CC3CCN(CC3)C(=O)C=C)c(=O)n(-c3ccc(Oc4ccccc4)cc3)c12 Show InChI InChI=1S/C26H26N6O3/c1-2-22(33)30-14-12-18(13-15-30)16-31-25-23(24(27)28-17-29-25)32(26(31)34)19-8-10-21(11-9-19)35-20-6-4-3-5-7-20/h2-11,17-18H,1,12-16H2,(H2,27,28,29)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
ONO PHARMACEUTICAL CO., LTD. US Patent					Assay Description The Btk enzyme inhibitory activity was measured, based on the protocol provided by the manufacturer, using Btk (Invitrogen Corporation) and the ZR...				US Patent US9879013 (2018) BindingDB Entry DOI: 10.7270/Q2X63PZ1
					More data for this Ligand-Target Pair