Compile Data Set for Download or QSAR

Found 377 hits with Last Name = 'blomgren' and Initial = 'pa'   

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))	BDBM111938 (US8618107, 104) Show SMILES Cn1cc(cc(Nc2ccncn2)c1=O)-c1cccc(N2CCc3c4CCCCc4sc3C2=O)c1CO Show InChI InChI=1S/C28H27N5O3S/c1-32-14-17(13-22(27(32)35)31-25-9-11-29-16-30-25)18-6-4-7-23(21(18)15-34)33-12-10-20-19-5-2-3-8-24(19)37-26(20)28(33)36/h4,6-7,9,11,13-14,16,34H,2-3,5,8,10,12,15H2,1H3,(H,29,30,31)	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	0.870	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111940 (US8618107, 106) Show SMILES Cn1cc(cc(Nc2cc(n[nH]2)C2CC2)c1=O)-c1cccc(N2CCn3c4CCCCc4cc3C2=O)c1CO Show InChI InChI=1S/C30H32N6O3/c1-34-16-20(13-24(29(34)38)31-28-15-23(32-33-28)18-9-10-18)21-6-4-8-26(22(21)17-37)36-12-11-35-25-7-3-2-5-19(25)14-27(35)30(36)39/h4,6,8,13-16,18,37H,2-3,5,7,9-12,17H2,1H3,(H2,31,32,33)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111953 (US8618107, 212) Show SMILES CN1CCN(CC1)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H37FN6O3S/c1-38-11-13-40(14-12-38)23-7-8-31(36-18-23)37-28-15-21(19-39(2)33(28)43)26-16-22(35)17-29(27(26)20-42)41-10-9-25-24-5-3-4-6-30(24)45-32(25)34(41)44/h7-8,15-19,42H,3-6,9-14,20H2,1-2H3,(H,36,37)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111975 (US8618107, 287) Show SMILES CN1CCCC1c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CC(C)(C)Cc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C35H38FN5O3S/c1-35(2)15-25-23-9-11-41(34(44)32(23)45-30(25)16-35)29-14-22(36)13-24(26(29)19-42)21-12-27(33(43)40(4)18-21)38-31-8-7-20(17-37-31)28-6-5-10-39(28)3/h7-8,12-14,17-18,28,42H,5-6,9-11,15-16,19H2,1-4H3,(H,37,38)	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	1.40	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111978 (US8618107, 291) Show SMILES CN1CCC[C@@H]1c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCn4c5CC(C)(C)Cc5cc4C3=O)c2CO)nc1 |r| Show InChI InChI=1S/C35H39FN6O3/c1-35(2)16-22-13-30-34(45)42(11-10-41(30)31(22)17-35)29-15-24(36)14-25(26(29)20-43)23-12-27(33(44)40(4)19-23)38-32-8-7-21(18-37-32)28-6-5-9-39(28)3/h7-8,12-15,18-19,28,43H,5-6,9-11,16-17,20H2,1-4H3,(H,37,38)/t28-/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	1.74	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111935 (US8618107, 101) Show SMILES CN1CCn2nc(Nc3cc(n[nH]c3=O)-c3cccc(N4CCn5c6CCCCc6cc5C4=O)c3C)cc2C1 Show InChI InChI=1S/C29H32N8O2/c1-18-21(22-16-23(28(38)32-31-22)30-27-15-20-17-34(2)10-13-37(20)33-27)7-5-9-24(18)36-12-11-35-25-8-4-3-6-19(25)14-26(35)29(36)39/h5,7,9,14-16H,3-4,6,8,10-13,17H2,1-2H3,(H,32,38)(H,30,31,33)	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	2	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111949 (US8618107, 131) Show SMILES CCn1cc(Nc2nc(cn(C)c2=O)-c2cccc(N3CCc4c5CC(C)(C)Cc5sc4C3=O)c2CO)cn1 Show InChI InChI=1S/C29H32N6O3S/c1-5-34-14-17(13-30-34)31-26-28(38)33(4)15-22(32-26)18-7-6-8-23(21(18)16-36)35-10-9-19-20-11-29(2,3)12-24(20)39-25(19)27(35)37/h6-8,13-15,36H,5,9-12,16H2,1-4H3,(H,31,32)	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	2	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111951 (US8618107, 197) Show SMILES CN1CCN(CC1)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCn4c5CCCCc5cc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H38FN7O3/c1-38-9-11-40(12-10-38)25-7-8-32(36-19-25)37-28-15-23(20-39(2)33(28)44)26-17-24(35)18-30(27(26)21-43)42-14-13-41-29-6-4-3-5-22(29)16-31(41)34(42)45/h7-8,15-20,43H,3-6,9-14,21H2,1-2H3,(H,36,37)	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	2	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111956 (US8618107, 268) Show SMILES CN(C)CCOc1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C33H36FN5O4S/c1-37(2)12-13-43-22-8-9-30(35-17-22)36-27-14-20(18-38(3)32(27)41)25-15-21(34)16-28(26(25)19-40)39-11-10-24-23-6-4-5-7-29(23)44-31(24)33(39)42/h8-9,14-18,40H,4-7,10-13,19H2,1-3H3,(H,35,36)	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	2	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111976 (US8618107, 288) Show SMILES CN1CCCC1c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H36FN5O3S/c1-38-12-5-7-28(38)20-9-10-31(36-17-20)37-27-14-21(18-39(2)33(27)42)25-15-22(35)16-29(26(25)19-41)40-13-11-24-23-6-3-4-8-30(23)44-32(24)34(40)43/h9-10,14-18,28,41H,3-8,11-13,19H2,1-2H3,(H,36,37)	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	2.10	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111982 (US8618107, 295) Show SMILES CN1CCC(CC1)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CC(C)(C)Cc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C36H40FN5O3S/c1-36(2)16-27-25-9-12-42(35(45)33(25)46-31(27)17-36)30-15-24(37)14-26(28(30)20-43)23-13-29(34(44)41(4)19-23)39-32-6-5-22(18-38-32)21-7-10-40(3)11-8-21/h5-6,13-15,18-19,21,43H,7-12,16-17,20H2,1-4H3,(H,38,39)	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	2.20	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111964 (US8618107, 276) Show SMILES Cc1cc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCn4c5CC(C)(C)Cc5cc4C3=O)c2CO)[nH]n1 Show InChI InChI=1S/C29H31FN6O3/c1-16-7-26(33-32-16)31-22-8-18(14-34(4)27(22)38)20-10-19(30)11-23(21(20)15-37)36-6-5-35-24(28(36)39)9-17-12-29(2,3)13-25(17)35/h7-11,14,37H,5-6,12-13,15H2,1-4H3,(H2,31,32,33)	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	2.20	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111962 (US8618107, 274) Show SMILES Cn1cc(cc(Nc2ccc(CN3CCOCC3)cn2)c1=O)-c1cc(F)cc(N2CCn3c4CC(C)(C)Cc4cc3C2=O)c1CO Show InChI InChI=1S/C35H39FN6O4/c1-35(2)16-23-13-30-34(45)42(7-6-41(30)31(23)17-35)29-15-25(36)14-26(27(29)21-43)24-12-28(33(44)39(3)20-24)38-32-5-4-22(18-37-32)19-40-8-10-46-11-9-40/h4-5,12-15,18,20,43H,6-11,16-17,19,21H2,1-3H3,(H,37,38)	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	2.34	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111966 (US8618107, 278) Show SMILES CN1CCC(CC1)c1ccc(Nc2nc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CC(C)(C)Cc5sc4C3=O)c2CO)cc1 Show InChI InChI=1S/C36H40FN5O3S/c1-36(2)17-27-25-11-14-42(34(44)32(25)46-31(27)18-36)30-16-23(37)15-26(28(30)20-43)29-19-41(4)35(45)33(39-29)38-24-7-5-21(6-8-24)22-9-12-40(3)13-10-22/h5-8,15-16,19,22,43H,9-14,17-18,20H2,1-4H3,(H,38,39)	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	2.60	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111972 (US8618107, 284) Show SMILES CCN1CCc2nc(Nc3cc(cn(C)c3=O)-c3cc(F)cc(N4CCn5c6CC(C)(C)Cc6cc5C4=O)c3CO)ccc2C1 Show InChI InChI=1S/C35H39FN6O3/c1-5-40-9-8-27-21(19-40)6-7-32(37-27)38-28-12-23(18-39(4)33(28)44)25-14-24(36)15-29(26(25)20-43)42-11-10-41-30(34(42)45)13-22-16-35(2,3)17-31(22)41/h6-7,12-15,18,43H,5,8-11,16-17,19-20H2,1-4H3,(H,37,38)	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	2.80	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111954 (US8618107, 265) Show SMILES Cn1cc(cc(Nc2ccc(cn2)C2CCN(CC2)C2COC2)c1=O)-c1cc(F)cc(N2CCn3c4CCCCc4cc3C2=O)c1CO Show InChI InChI=1S/C37H41FN6O4/c1-41-19-26(14-31(36(41)46)40-35-7-6-25(18-39-35)23-8-10-42(11-9-23)28-21-48-22-28)29-16-27(38)17-33(30(29)20-45)44-13-12-43-32-5-3-2-4-24(32)15-34(43)37(44)47/h6-7,14-19,23,28,45H,2-5,8-13,20-22H2,1H3,(H,39,40)	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	2.80	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111948 (US8618107, 123) Show SMILES Cn1cc(cc(Nc2cc(n[nH]2)C2CC2)c1=O)-c1cccc(N2CCc3c4CCCCc4sc3C2=O)c1CO Show InChI InChI=1S/C30H31N5O3S/c1-34-15-18(13-24(29(34)37)31-27-14-23(32-33-27)17-9-10-17)19-6-4-7-25(22(19)16-36)35-12-11-21-20-5-2-3-8-26(20)39-28(21)30(35)38/h4,6-7,13-15,17,36H,2-3,5,8-12,16H2,1H3,(H2,31,32,33)	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	3	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111983 (US8618107, 296) Show SMILES CN(C)CCOc1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CC(C)(C)Cc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H38FN5O4S/c1-34(2)15-25-23-8-9-40(33(43)31(23)45-29(25)16-34)28-14-21(35)13-24(26(28)19-41)20-12-27(32(42)39(5)18-20)37-30-7-6-22(17-36-30)44-11-10-38(3)4/h6-7,12-14,17-18,41H,8-11,15-16,19H2,1-5H3,(H,36,37)	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	3	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111994 (US8618107, 308) Show SMILES CN1CCC(C1)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H36FN5O3S/c1-38-11-9-21(17-38)20-7-8-31(36-16-20)37-28-13-22(18-39(2)33(28)42)26-14-23(35)15-29(27(26)19-41)40-12-10-25-24-5-3-4-6-30(24)44-32(25)34(40)43/h7-8,13-16,18,21,41H,3-6,9-12,17,19H2,1-2H3,(H,36,37)	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	3.30	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111987 (US8618107, 300) Show SMILES COc1nccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCn4c5CC(C)(C)Cc5cc4C3=O)c2CO)n1 Show InChI InChI=1S/C30H31FN6O4/c1-30(2)13-17-10-24-28(40)37(8-7-36(24)25(17)14-30)23-12-19(31)11-20(21(23)16-38)18-9-22(27(39)35(3)15-18)33-26-5-6-32-29(34-26)41-4/h5-6,9-12,15,38H,7-8,13-14,16H2,1-4H3,(H,32,33,34)	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	3.40	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111965 (US8618107, 277) Show SMILES CC(C)N(C)Cc1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H38FN5O3S/c1-20(2)38(3)17-21-9-10-31(36-16-21)37-28-13-22(18-39(4)33(28)42)26-14-23(35)15-29(27(26)19-41)40-12-11-25-24-7-5-6-8-30(24)44-32(25)34(40)43/h9-10,13-16,18,20,41H,5-8,11-12,17,19H2,1-4H3,(H,36,37)	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	3.40	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111974 (US8618107, 286) Show SMILES CN(C)CCN(C)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H39FN6O3S/c1-38(2)13-14-39(3)23-9-10-31(36-18-23)37-28-15-21(19-40(4)33(28)43)26-16-22(35)17-29(27(26)20-42)41-12-11-25-24-7-5-6-8-30(24)45-32(25)34(41)44/h9-10,15-19,42H,5-8,11-14,20H2,1-4H3,(H,36,37)	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	3.40	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111973 (US8618107, 285) Show SMILES CCN1CCn2nc(Nc3cc(cn(C)c3=O)-c3cc(F)cc(N4CCn5c6CC(C)(C)Cc6cc5C4=O)c3CO)cc2C1 Show InChI InChI=1S/C33H38FN7O3/c1-5-38-6-9-41-23(18-38)14-30(36-41)35-26-10-21(17-37(4)31(26)43)24-12-22(34)13-27(25(24)19-42)40-8-7-39-28(32(40)44)11-20-15-33(2,3)16-29(20)39/h10-14,17,42H,5-9,15-16,18-19H2,1-4H3,(H,35,36)	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	3.60	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111955 (US8618107, 267) Show SMILES CN1CCC(CC1)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C35H38FN5O3S/c1-39-12-9-21(10-13-39)22-7-8-32(37-18-22)38-29-15-23(19-40(2)34(29)43)27-16-24(36)17-30(28(27)20-42)41-14-11-26-25-5-3-4-6-31(25)45-33(26)35(41)44/h7-8,15-19,21,42H,3-6,9-14,20H2,1-2H3,(H,37,38)	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	3.80	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111952 (US8618107, 210) Show SMILES Cn1cc(cc(Nc2ccc(cn2)N2CCN(CC2)C2COC2)c1=O)-c1cc(F)cc(N2CCn3c4CCCCc4cc3C2=O)c1CO Show InChI InChI=1S/C36H40FN7O4/c1-40-19-24(14-30(35(40)46)39-34-7-6-26(18-38-34)41-8-10-42(11-9-41)27-21-48-22-27)28-16-25(37)17-32(29(28)20-45)44-13-12-43-31-5-3-2-4-23(31)15-33(43)36(44)47/h6-7,14-19,27,45H,2-5,8-13,20-22H2,1H3,(H,38,39)	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	3.90	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111958 (US8618107, 270) Show SMILES CN(C)CCN(C)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CC(C)(C)Cc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C35H41FN6O3S/c1-35(2)16-26-24-9-10-42(34(45)32(24)46-30(26)17-35)29-15-22(36)14-25(27(29)20-43)21-13-28(33(44)41(6)19-21)38-31-8-7-23(18-37-31)40(5)12-11-39(3)4/h7-8,13-15,18-19,43H,9-12,16-17,20H2,1-6H3,(H,37,38)	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	4	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111957 (US8618107, 269) Show SMILES CCN1CCN(CC1)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)nc1 Show InChI InChI=1S/C35H39FN6O3S/c1-3-40-12-14-41(15-13-40)24-8-9-32(37-19-24)38-29-16-22(20-39(2)34(29)44)27-17-23(36)18-30(28(27)21-43)42-11-10-26-25-6-4-5-7-31(25)46-33(26)35(42)45/h8-9,16-20,43H,3-7,10-15,21H2,1-2H3,(H,37,38)	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	4	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111970 (US8618107, 282) Show SMILES CN1CCC(CC1)c1ccc(Nc2nc(cn(C)c2=O)-c2cc(F)cc(N3CCn4c5CCCCc5cc4C3=O)c2CO)cc1 Show InChI InChI=1S/C35H39FN6O3/c1-39-13-11-23(12-14-39)22-7-9-26(10-8-22)37-33-35(45)40(2)20-29(38-33)27-18-25(36)19-31(28(27)21-43)42-16-15-41-30-6-4-3-5-24(30)17-32(41)34(42)44/h7-10,17-20,23,43H,3-6,11-16,21H2,1-2H3,(H,37,38)	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	4	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111984 (US8618107, 297) Show SMILES CN(C)CCOc1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCn4c5CCCCc5cc4C3=O)c2CO)nc1 Show InChI InChI=1S/C33H37FN6O4/c1-37(2)12-13-44-24-8-9-31(35-18-24)36-27-14-22(19-38(3)32(27)42)25-16-23(34)17-29(26(25)20-41)40-11-10-39-28-7-5-4-6-21(28)15-30(39)33(40)43/h8-9,14-19,41H,4-7,10-13,20H2,1-3H3,(H,35,36)	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	4.20	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111968 (US8618107, 280) Show SMILES Cn1cc(cc(Nc2ccc3CN(CCc3n2)C2COC2)c1=O)-c1cc(F)cc(N2CCc3c4CC(C)(C)Cc4sc3C2=O)c1CO Show InChI InChI=1S/C36H38FN5O4S/c1-36(2)13-26-24-6-9-42(35(45)33(24)47-31(26)14-36)30-12-22(37)11-25(27(30)17-43)21-10-29(34(44)40(3)15-21)39-32-5-4-20-16-41(23-18-46-19-23)8-7-28(20)38-32/h4-5,10-12,15,23,43H,6-9,13-14,16-19H2,1-3H3,(H,38,39)	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	4.20	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111959 (US8618107, 271) Show SMILES CN1CC(C1)c1ccc(Nc2cc(cn(C)c2=O)-c2cc(F)cc(N3CCn4c5CC(C)(C)Cc5cc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H37FN6O3/c1-34(2)13-21-10-29-33(44)41(8-7-40(29)30(21)14-34)28-12-24(35)11-25(26(28)19-42)22-9-27(32(43)39(4)18-22)37-31-6-5-20(15-36-31)23-16-38(3)17-23/h5-6,9-12,15,18,23,42H,7-8,13-14,16-17,19H2,1-4H3,(H,36,37)	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	4.70	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111990 (US8618107, 303) Show SMILES Cn1cc(cc(Nc2ccc(cn2)C2CCN(CC2)C2COC2)c1=O)-c1cc(F)cc(N2CCc3c4CCCCc4sc3C2=O)c1CO Show InChI InChI=1S/C37H40FN5O4S/c1-41-18-24(14-31(36(41)45)40-34-7-6-23(17-39-34)22-8-11-42(12-9-22)26-20-47-21-26)29-15-25(38)16-32(30(29)19-44)43-13-10-28-27-4-2-3-5-33(27)48-35(28)37(43)46/h6-7,14-18,22,26,44H,2-5,8-13,19-21H2,1H3,(H,39,40)	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	4.90	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111967 (US8618107, 279) Show SMILES CN1CCn2nc(Nc3cc(cn(C)c3=O)-c3cc(F)cc(N4CCc5c6CC(C)(C)Cc6sc5C4=O)c3CO)cc2C1 Show InChI InChI=1S/C32H35FN6O3S/c1-32(2)13-23-21-5-6-38(31(42)29(21)43-27(23)14-32)26-11-19(33)10-22(24(26)17-40)18-9-25(30(41)37(4)15-18)34-28-12-20-16-36(3)7-8-39(20)35-28/h9-12,15,40H,5-8,13-14,16-17H2,1-4H3,(H,34,35)	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	4.90	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111977 (US8618107, 289) Show SMILES Cn1cc(cc(Nc2ccc(cn2)N2CCOCC2)c1=O)-c1cc(F)cc(N2CCc3c4CCCCc4sc3C2=O)c1CO Show InChI InChI=1S/C33H34FN5O4S/c1-37-18-20(14-27(32(37)41)36-30-7-6-22(17-35-30)38-10-12-43-13-11-38)25-15-21(34)16-28(26(25)19-40)39-9-8-24-23-4-2-3-5-29(23)44-31(24)33(39)42/h6-7,14-18,40H,2-5,8-13,19H2,1H3,(H,35,36)	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	5	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111950 (US8618107, 149) Show SMILES Cn1cc(cc(Nc2cc3COCCn3n2)c1=O)-c1cc(F)cc(N2CCn3c4CCCCc4cc3C2=O)c1CO Show InChI InChI=1S/C30H31FN6O4/c1-34-15-19(10-24(29(34)39)32-28-14-21-17-41-9-8-37(21)33-28)22-12-20(31)13-26(23(22)16-38)36-7-6-35-25-5-3-2-4-18(25)11-27(35)30(36)40/h10-15,38H,2-9,16-17H2,1H3,(H,32,33)	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	5	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111945 (US8618107, 113) Show SMILES CN1CCN(CC1)c1ccc(Nc2cc(cn(C)c2=O)-c2cccc(N3CCn4c5CCCCc5cc4C3=O)c2CO)nc1 Show InChI InChI=1S/C34H39N7O3/c1-37-12-14-39(15-13-37)25-10-11-32(35-20-25)36-28-18-24(21-38(2)33(28)43)26-7-5-9-30(27(26)22-42)41-17-16-40-29-8-4-3-6-23(29)19-31(40)34(41)44/h5,7,9-11,18-21,42H,3-4,6,8,12-17,22H2,1-2H3,(H,35,36)	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	5	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111997 (US8618107, 311) Show SMILES Cn1cc(cc(Nc2ccc(cn2)N2CCN(CC2)C2COC2)c1=O)-c1cccc(N2CCn3c4CC(C)(C)Cc4cc3C2=O)c1CO Show InChI InChI=1S/C37H43N7O4/c1-37(2)17-24-16-32-36(47)44(14-13-43(32)33(24)18-37)31-6-4-5-28(29(31)21-45)25-15-30(35(46)40(3)20-25)39-34-8-7-26(19-38-34)41-9-11-42(12-10-41)27-22-48-23-27/h4-8,15-16,19-20,27,45H,9-14,17-18,21-23H2,1-3H3,(H,38,39)	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	5.20	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111969 (US8618107, 281) Show SMILES CN1CCC(CC1)c1ccc(Nc2nc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CCCCc5sc4C3=O)c2CO)cc1 Show InChI InChI=1S/C35H38FN5O3S/c1-39-14-11-22(12-15-39)21-7-9-24(10-8-21)37-33-35(44)40(2)19-29(38-33)27-17-23(36)18-30(28(27)20-42)41-16-13-26-25-5-3-4-6-31(25)45-32(26)34(41)43/h7-10,17-19,22,42H,3-6,11-16,20H2,1-2H3,(H,37,38)	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	5.20	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111985 (US8618107, 298) Show SMILES CN1CC(C1)c1ccc(Nc2nc(cn(C)c2=O)-c2cc(F)cc(N3CCc4c5CC(C)(C)Cc5sc4C3=O)c2CO)cc1 Show InChI InChI=1S/C34H36FN5O3S/c1-34(2)13-25-23-9-10-40(32(42)30(23)44-29(25)14-34)28-12-21(35)11-24(26(28)18-41)27-17-39(4)33(43)31(37-27)36-22-7-5-19(6-8-22)20-15-38(3)16-20/h5-8,11-12,17,20,41H,9-10,13-16,18H2,1-4H3,(H,36,37)	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	5.30	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111946 (US8618107, 116) Show SMILES Cn1cc(nc(Nc2cnn(CCO)c2)c1=O)-c1cccc(N2CCc3c4CCCCc4sc3C2=O)c1CO Show InChI InChI=1S/C28H30N6O4S/c1-32-15-22(31-26(28(32)38)30-17-13-29-33(14-17)11-12-35)18-6-4-7-23(21(18)16-36)34-10-9-20-19-5-2-3-8-24(19)39-25(20)27(34)37/h4,6-7,13-15,35-36H,2-3,5,8-12,16H2,1H3,(H,30,31)	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	6	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111988 (US8618107, 301) Show SMILES Cn1cc(cc(Nc2ccc(cn2)N2CCNCC2)c1=O)-c1cccc(N2CCn3c4CCCCc4cc3C2=O)c1CO Show InChI InChI=1S/C33H37N7O3/c1-37-20-23(17-27(32(37)42)36-31-10-9-24(19-35-31)38-13-11-34-12-14-38)25-6-4-8-29(26(25)21-41)40-16-15-39-28-7-3-2-5-22(28)18-30(39)33(40)43/h4,6,8-10,17-20,34,41H,2-3,5,7,11-16,21H2,1H3,(H,35,36)	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	6.10	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111942 (US8618107, 108) Show SMILES CC(=O)N1CCn2nc(Nc3cc(cn(C)c3=O)-c3cccc(N4CCn5c6CCCCc6cc5C4=O)c3CO)cc2C1 Show InChI InChI=1S/C32H35N7O4/c1-20(41)36-10-13-39-23(18-36)16-30(34-39)33-26-14-22(17-35(2)31(26)42)24-7-5-9-28(25(24)19-40)38-12-11-37-27-8-4-3-6-21(27)15-29(37)32(38)43/h5,7,9,14-17,40H,3-4,6,8,10-13,18-19H2,1-2H3,(H,33,34)	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	6.10	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM212270 (6-(6-amino-5-methylpyrazin-2-yl)-N-(4-(4-(oxetan-3...) Show SMILES Cc1ncc(nc1N)-c1cn2ccnc2c(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 Show InChI InChI=1S/C24H27N9O/c1-16-22(25)29-20(12-27-16)21-13-33-7-6-26-24(33)23(30-21)28-17-2-4-18(5-3-17)31-8-10-32(11-9-31)19-14-34-15-19/h2-7,12-13,19H,8-11,14-15H2,1H3,(H2,25,29)(H,28,30)	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	6.20	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee					Assay Description Syk activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, Syk-ca...				Bioorg Med Chem 16: 8853-62 (2008) BindingDB Entry DOI: 10.7270/Q2K076M3
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM212270 (6-(6-amino-5-methylpyrazin-2-yl)-N-(4-(4-(oxetan-3...) Show SMILES Cc1ncc(nc1N)-c1cn2ccnc2c(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 Show InChI InChI=1S/C24H27N9O/c1-16-22(25)29-20(12-27-16)21-13-33-7-6-26-24(33)23(30-21)28-17-2-4-18(5-3-17)31-8-10-32(11-9-31)19-14-34-15-19/h2-7,12-13,19H,8-11,14-15H2,1H3,(H2,25,29)(H,28,30)	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	6.20	n/a	n/a	n/a	n/a	n/a	n/a
Gilead Sciences Inc US Patent					Assay Description Syk activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, Syk-ca...				US Patent US10342794 (2019) BindingDB Entry DOI: 10.7270/Q2R49T3H
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111943 (US8618107, 109) Show SMILES Cn1cc(cc(Nc2ccncn2)c1=O)-c1cccc(N2CCn3c4CCCCc4cc3C2=O)c1CO Show InChI InChI=1S/C28H28N6O3/c1-32-15-19(13-22(27(32)36)31-26-9-10-29-17-30-26)20-6-4-8-24(21(20)16-35)34-12-11-33-23-7-3-2-5-18(23)14-25(33)28(34)37/h4,6,8-10,13-15,17,35H,2-3,5,7,11-12,16H2,1H3,(H,29,30,31)	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	6.20	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM212270 (6-(6-amino-5-methylpyrazin-2-yl)-N-(4-(4-(oxetan-3...) Show SMILES Cc1ncc(nc1N)-c1cn2ccnc2c(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 Show InChI InChI=1S/C24H27N9O/c1-16-22(25)29-20(12-27-16)21-13-33-7-6-26-24(33)23(30-21)28-17-2-4-18(5-3-17)31-8-10-32(11-9-31)19-14-34-15-19/h2-7,12-13,19H,8-11,14-15H2,1H3,(H2,25,29)(H,28,30)	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	6.20	n/a	n/a	n/a	n/a	7.0	25
Gilead Sciences, Inc. US Patent					Assay Description Syk activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, Syk-ca...				US Patent US9504684 (2016) BindingDB Entry DOI: 10.7270/Q2XS5TB7
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM212270 (6-(6-amino-5-methylpyrazin-2-yl)-N-(4-(4-(oxetan-3...) Show SMILES Cc1ncc(nc1N)-c1cn2ccnc2c(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 Show InChI InChI=1S/C24H27N9O/c1-16-22(25)29-20(12-27-16)21-13-33-7-6-26-24(33)23(30-21)28-17-2-4-18(5-3-17)31-8-10-32(11-9-31)19-14-34-15-19/h2-7,12-13,19H,8-11,14-15H2,1H3,(H2,25,29)(H,28,30)	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	6.20	n/a	n/a	n/a	n/a	7.0	n/a
Gilead Sciences, Inc. US Patent					Assay Description Syk activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, Syk-ca...				US Patent US9290505 (2016) BindingDB Entry DOI: 10.7270/Q2TB15RT
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM212270 (6-(6-amino-5-methylpyrazin-2-yl)-N-(4-(4-(oxetan-3...) Show SMILES Cc1ncc(nc1N)-c1cn2ccnc2c(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 Show InChI InChI=1S/C24H27N9O/c1-16-22(25)29-20(12-27-16)21-13-33-7-6-26-24(33)23(30-21)28-17-2-4-18(5-3-17)31-8-10-32(11-9-31)19-14-34-15-19/h2-7,12-13,19H,8-11,14-15H2,1H3,(H2,25,29)(H,28,30)	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	6.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Syk activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, Syk-ca...				Citation and Details BindingDB Entry DOI: 10.7270/Q2KD22RG
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM212270 (6-(6-amino-5-methylpyrazin-2-yl)-N-(4-(4-(oxetan-3...) Show SMILES Cc1ncc(nc1N)-c1cn2ccnc2c(Nc2ccc(cc2)N2CCN(CC2)C2COC2)n1 Show InChI InChI=1S/C24H27N9O/c1-16-22(25)29-20(12-27-16)21-13-33-7-6-26-24(33)23(30-21)28-17-2-4-18(5-3-17)31-8-10-32(11-9-31)19-14-34-15-19/h2-7,12-13,19H,8-11,14-15H2,1H3,(H2,25,29)(H,28,30)	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	6.20	n/a	n/a	n/a	n/a	n/a	n/a
KRONOS BIO, INC. US Patent					Assay Description Syk activity was measured using KinEASE (Cisbio), a time-resolved fluorescence resonance energy transfer (TR-FRET) immunoassay. In this assay, Syk-ca...				US Patent US10828299 (2020) BindingDB Entry DOI: 10.7270/Q2PK0K6D
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM111961 (US8618107, 273) Show SMILES Cn1cc(cc(Nc2ccc(cn2)N2CCN(CCF)CC2)c1=O)-c1cc(F)cc(N2CCn3c4CC(C)(C)Cc4cc3C2=O)c1CO Show InChI InChI=1S/C36H41F2N7O3/c1-36(2)18-23-15-31-35(48)45(13-12-44(31)32(23)19-36)30-17-25(38)16-27(28(30)22-46)24-14-29(34(47)41(3)21-24)40-33-5-4-26(20-39-33)43-10-8-42(7-6-37)9-11-43/h4-5,14-17,20-21,46H,6-13,18-19,22H2,1-3H3,(H,39,40)	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	6.35	n/a	n/a	n/a	n/a	7.5	n/a
Gilead Connecticut, Inc.; Genentech, Inc. US Patent					Assay Description A generalized procedure for a standard biochemical Btk Kinase Assay that can be used to test Formula I compounds. Alternatively, the Lanthascreen ass...				US Patent US8618107 (2013) BindingDB Entry DOI: 10.7270/Q2T72G3C
					More data for this Ligand-Target Pair

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