Compile Data Set for Download or QSAR

Found 293 hits with Last Name = 'sapountzis' and Initial = 'i'   

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
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134150 (US8846689, 152) Show SMILES CO[C@@H]1CN(C)CC[C@@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4[C@H](C)N(C)C(=O)c34)n2)cc1Cl |r| Show InChI InChI=1S/C29H32Cl2N6O5/c1-15-16-7-6-8-22(25(16)28(39)37(15)3)42-27-19(31)13-32-29(35-27)34-21-12-18(30)17(11-23(21)40-4)26(38)33-20-9-10-36(2)14-24(20)41-5/h6-8,11-13,15,20,24H,9-10,14H2,1-5H3,(H,33,38)(H,32,34,35)/t15-,20-,24+/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134155 (US8846689, 157) Show SMILES CON1Cc2cccc(Oc3nc(Nc4cc(F)c(cc4OC)C(=O)N[C@H]4CCN(C)C[C@H]4F)ncc3Cl)c2C1=O |r| Show InChI InChI=1S/C27H27ClF2N6O5/c1-35-8-7-19(18(30)13-35)32-24(37)15-9-22(39-2)20(10-17(15)29)33-27-31-11-16(28)25(34-27)41-21-6-4-5-14-12-36(40-3)26(38)23(14)21/h4-6,9-11,18-19H,7-8,12-13H2,1-3H3,(H,32,37)(H,31,33,34)/t18-,19+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134156 (US8846689, 158) Show SMILES CO[C@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4CN(OC)C(=O)c34)n2)cc1F |r| Show InChI InChI=1S/C28H30ClFN6O6/c1-35-9-8-19(23(14-35)40-3)32-25(37)16-10-22(39-2)20(11-18(16)30)33-28-31-12-17(29)26(34-28)42-21-7-5-6-15-13-36(41-4)27(38)24(15)21/h5-7,10-12,19,23H,8-9,13-14H2,1-4H3,(H,32,37)(H,31,33,34)/t19-,23+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134157 (US8846689, 159) Show SMILES CO[C@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4[C@@H](C)N(C)C(=O)c34)n2)cc1Cl |r| Show InChI InChI=1S/C29H32Cl2N6O5/c1-15-16-7-6-8-22(25(16)28(39)37(15)3)42-27-19(31)13-32-29(35-27)34-21-12-18(30)17(11-23(21)40-4)26(38)33-20-9-10-36(2)14-24(20)41-5/h6-8,11-13,15,20,24H,9-10,14H2,1-5H3,(H,33,38)(H,32,34,35)/t15-,20-,24+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134158 (US8846689, 160) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3[C@@H](C)N(C)C(=O)c23)n1 |r| Show InChI InChI=1S/C28H29Cl2FN6O4/c1-14-15-6-5-7-22(24(15)27(39)37(14)3)41-26-18(30)12-32-28(35-26)34-21-11-17(29)16(10-23(21)40-4)25(38)33-20-8-9-36(2)13-19(20)31/h5-7,10-12,14,19-20H,8-9,13H2,1-4H3,(H,33,38)(H,32,34,35)/t14-,19-,20+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134159 (US8846689, 161) Show SMILES CO[C@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4[C@H](C)N(C)C(=O)c34)n2)cc1F |r| Show InChI InChI=1S/C29H32ClFN6O5/c1-15-16-7-6-8-22(25(16)28(39)37(15)3)42-27-18(30)13-32-29(35-27)34-21-12-19(31)17(11-23(21)40-4)26(38)33-20-9-10-36(2)14-24(20)41-5/h6-8,11-13,15,20,24H,9-10,14H2,1-5H3,(H,33,38)(H,32,34,35)/t15-,20+,24-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134160 (US8846689, 162) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3[C@@H](C)N(C)C(=O)c23)n1 |r| Show InChI InChI=1S/C28H29ClF2N6O4/c1-14-15-6-5-7-22(24(15)27(39)37(14)3)41-26-17(29)12-32-28(35-26)34-21-11-18(30)16(10-23(21)40-4)25(38)33-20-8-9-36(2)13-19(20)31/h5-7,10-12,14,19-20H,8-9,13H2,1-4H3,(H,33,38)(H,32,34,35)/t14-,19-,20+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134161 (US8846689, 163) Show SMILES CO[C@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4[C@@H](C)N(C)C(=O)c34)n2)cc1F |r| Show InChI InChI=1S/C29H32ClFN6O5/c1-15-16-7-6-8-22(25(16)28(39)37(15)3)42-27-18(30)13-32-29(35-27)34-21-12-19(31)17(11-23(21)40-4)26(38)33-20-9-10-36(2)14-24(20)41-5/h6-8,11-13,15,20,24H,9-10,14H2,1-5H3,(H,33,38)(H,32,34,35)/t15-,20-,24+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134162 (US8846689, 164) Show SMILES CCN1CC[C@H](NC(=O)c2cc(OC)c(Nc3ncc(Cl)c(Oc4cccc5[C@H](C)N(C)C(=O)c45)n3)cc2F)[C@H](F)C1 |r| Show InChI InChI=1S/C29H31ClF2N6O4/c1-5-38-10-9-21(20(32)14-38)34-26(39)17-11-24(41-4)22(12-19(17)31)35-29-33-13-18(30)27(36-29)42-23-8-6-7-16-15(2)37(3)28(40)25(16)23/h6-8,11-13,15,20-21H,5,9-10,14H2,1-4H3,(H,34,39)(H,33,35,36)/t15-,20+,21-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134164 (US8846689, 166) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(F)cc1Nc1ncc(Cl)c(Oc2cccc3[C@H](C)N(C)C(=O)c23)n1 |r| Show InChI InChI=1S/C28H29ClF2N6O4/c1-14-15-6-5-7-22(24(15)27(39)37(14)3)41-26-17(29)12-32-28(35-26)34-21-11-18(30)16(10-23(21)40-4)25(38)33-20-8-9-36(2)13-19(20)31/h5-7,10-12,14,19-20H,8-9,13H2,1-4H3,(H,33,38)(H,32,34,35)/t14-,19+,20-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134166 (US8846689, 168) Show SMILES CO[C@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4CN(C)C(=O)c34)n2)cc1F |r| Show InChI InChI=1S/C28H30ClFN6O5/c1-35-9-8-19(23(14-35)40-4)32-25(37)16-10-22(39-3)20(11-18(16)30)33-28-31-12-17(29)26(34-28)41-21-7-5-6-15-13-36(2)27(38)24(15)21/h5-7,10-12,19,23H,8-9,13-14H2,1-4H3,(H,32,37)(H,31,33,34)/t19-,23+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134167 (US8846689, 169) Show SMILES CO[C@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4CN(C)C(=O)c34)n2)cc1C |r| Show InChI InChI=1S/C29H33ClN6O5/c1-16-11-21(23(39-4)12-18(16)26(37)32-20-9-10-35(2)15-24(20)40-5)33-29-31-13-19(30)27(34-29)41-22-8-6-7-17-14-36(3)28(38)25(17)22/h6-8,11-13,20,24H,9-10,14-15H2,1-5H3,(H,32,37)(H,31,33,34)/t20-,24+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134168 (US8846689, 170) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(C)cc1Nc1ncc(Cl)c(Oc2cccc3CN(C)C(=O)c23)n1 |r| Show InChI InChI=1S/C28H30ClFN6O4/c1-15-10-21(23(39-4)11-17(15)25(37)32-20-8-9-35(2)14-19(20)30)33-28-31-12-18(29)26(34-28)40-22-7-5-6-16-13-36(3)27(38)24(16)22/h5-7,10-12,19-20H,8-9,13-14H2,1-4H3,(H,32,37)(H,31,33,34)/t19-,20+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134170 (US8846689, 172) Show SMILES CO[C@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4c3C(=O)N(C)C4(C)C)n2)cc1C |r| Show InChI InChI=1S/C31H37ClN6O5/c1-17-13-22(24(41-6)14-18(17)27(39)34-21-11-12-37(4)16-25(21)42-7)35-30-33-15-20(32)28(36-30)43-23-10-8-9-19-26(23)29(40)38(5)31(19,2)3/h8-10,13-15,21,25H,11-12,16H2,1-7H3,(H,34,39)(H,33,35,36)/t21-,25+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134171 (US8846689, 173) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(C)cc1Nc1ncc(Cl)c(Oc2cccc3c2C(=O)N(C)C3(C)C)n1 |r| Show InChI InChI=1S/C30H34ClFN6O4/c1-16-12-22(24(41-6)13-17(16)26(39)34-21-10-11-37(4)15-20(21)32)35-29-33-14-19(31)27(36-29)42-23-9-7-8-18-25(23)28(40)38(5)30(18,2)3/h7-9,12-14,20-21H,10-11,15H2,1-6H3,(H,34,39)(H,33,35,36)/t20-,21+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134178 (US8846689, 180) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)C(=O)NC1CCN(CCO)CC1 Show InChI InChI=1S/C29H31F3N6O5/c1-37-16-18-4-3-5-22(24(18)27(37)41)43-26-20(29(30,31)32)15-33-28(36-26)35-21-7-6-17(14-23(21)42-2)25(40)34-19-8-10-38(11-9-19)12-13-39/h3-7,14-15,19,39H,8-13,16H2,1-2H3,(H,34,40)(H,33,35,36)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134179 (US8846689, 181) Show SMILES CONC(=O)c1ccc(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)c(OC)c1 Show InChI InChI=1S/C23H20F3N5O5/c1-31-11-13-5-4-6-16(18(13)21(31)33)36-20-14(23(24,25)26)10-27-22(29-20)28-15-8-7-12(9-17(15)34-2)19(32)30-35-3/h4-10H,11H2,1-3H3,(H,30,32)(H,27,28,29)	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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134182 (US8846689, 184) Show SMILES CN1Cc2cccc(Oc3nc(Nc4ccc(cc4C)C(=O)NC4CCN(CCO)CC4)ncc3C(F)(F)F)c2C1=O Show InChI InChI=1S/C29H31F3N6O4/c1-17-14-18(25(40)34-20-8-10-38(11-9-20)12-13-39)6-7-22(17)35-28-33-15-21(29(30,31)32)26(36-28)42-23-5-3-4-19-16-37(2)27(41)24(19)23/h3-7,14-15,20,39H,8-13,16H2,1-2H3,(H,34,40)(H,33,35,36)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134184 (US8846689, 186) Show SMILES COCCN1CCC(CC1)NC(=O)c1ccc(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)c(C)c1 Show InChI InChI=1S/C30H33F3N6O4/c1-18-15-19(26(40)35-21-9-11-39(12-10-21)13-14-42-3)7-8-23(18)36-29-34-16-22(30(31,32)33)27(37-29)43-24-6-4-5-20-17-38(2)28(41)25(20)24/h4-8,15-16,21H,9-14,17H2,1-3H3,(H,35,40)(H,34,36,37)	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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134189 (US8846689, 191) Show SMILES COCCN1CCC(CC1)NC(=O)c1ccc(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)c(OC)c1 Show InChI InChI=1S/C30H33F3N6O5/c1-38-17-19-5-4-6-23(25(19)28(38)41)44-27-21(30(31,32)33)16-34-29(37-27)36-22-8-7-18(15-24(22)43-3)26(40)35-20-9-11-39(12-10-20)13-14-42-2/h4-8,15-16,20H,9-14,17H2,1-3H3,(H,35,40)(H,34,36,37)	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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134190 (US8846689, 192) Show SMILES CN1Cc2cccc(Oc3nc(Nc4ccc(cc4C)C(=O)NC4CCCN(C)C4)ncc3C(F)(F)F)c2C1=O Show InChI InChI=1S/C28H29F3N6O3/c1-16-12-17(24(38)33-19-7-5-11-36(2)15-19)9-10-21(16)34-27-32-13-20(28(29,30)31)25(35-27)40-22-8-4-6-18-14-37(3)26(39)23(18)22/h4,6,8-10,12-13,19H,5,7,11,14-15H2,1-3H3,(H,33,38)(H,32,34,35)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134191 (US8846689, 193) Show SMILES CN1Cc2cccc(Oc3nc(Nc4ccc(cc4C)C(=O)NC4CCN(C)CC4)ncc3C(F)(F)F)c2C1=O Show InChI InChI=1S/C28H29F3N6O3/c1-16-13-17(24(38)33-19-9-11-36(2)12-10-19)7-8-21(16)34-27-32-14-20(28(29,30)31)25(35-27)40-22-6-4-5-18-15-37(3)26(39)23(18)22/h4-8,13-14,19H,9-12,15H2,1-3H3,(H,33,38)(H,32,34,35)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134193 (US8846689, 195) Show SMILES COCCNC(=O)c1ccc(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)c(OC)c1 Show InChI InChI=1S/C25H24F3N5O5/c1-33-13-15-5-4-6-18(20(15)23(33)35)38-22-16(25(26,27)28)12-30-24(32-22)31-17-8-7-14(11-19(17)37-3)21(34)29-9-10-36-2/h4-8,11-12H,9-10,13H2,1-3H3,(H,29,34)(H,30,31,32)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134196 (US8846689, 198) Show SMILES COc1cc(C[C@@H](O)CO)ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F |r| Show InChI InChI=1S/C24H23F3N4O5/c1-31-11-14-4-3-5-18(20(14)22(31)34)36-21-16(24(25,26)27)10-28-23(30-21)29-17-7-6-13(8-15(33)12-32)9-19(17)35-2/h3-7,9-10,15,32-33H,8,11-12H2,1-2H3,(H,28,29,30)/t15-/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134197 (US8846689, 199) Show SMILES COc1cc(C[C@H](O)CO)ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F |r| Show InChI InChI=1S/C24H23F3N4O5/c1-31-11-14-4-3-5-18(20(14)22(31)34)36-21-16(24(25,26)27)10-28-23(30-21)29-17-7-6-13(8-15(33)12-32)9-19(17)35-2/h3-7,9-10,15,32-33H,8,11-12H2,1-2H3,(H,28,29,30)/t15-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134198 (US8846689, 200) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)N1CCN(CC1)C(C)C Show InChI InChI=1S/C28H31F3N6O3/c1-17(2)36-10-12-37(13-11-36)19-8-9-21(23(14-19)39-4)33-27-32-15-20(28(29,30)31)25(34-27)40-22-7-5-6-18-16-35(3)26(38)24(18)22/h5-9,14-15,17H,10-13,16H2,1-4H3,(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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134199 (US8846689, 201) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)N1CCN(CC(=O)N(C)C)CC1 Show InChI InChI=1S/C29H32F3N7O4/c1-36(2)24(40)17-38-10-12-39(13-11-38)19-8-9-21(23(14-19)42-4)34-28-33-15-20(29(30,31)32)26(35-28)43-22-7-5-6-18-16-37(3)27(41)25(18)22/h5-9,14-15H,10-13,16-17H2,1-4H3,(H,33,34,35)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134205 (US8846689, 207) Show SMILES CO[C@@H]1CN(C)CCC1NC(=O)c1ccc(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)c(OC)c1 |r| Show InChI InChI=1S/C29H31F3N6O5/c1-37-11-10-20(23(15-37)42-4)34-25(39)16-8-9-19(22(12-16)41-3)35-28-33-13-18(29(30,31)32)26(36-28)43-21-7-5-6-17-14-38(2)27(40)24(17)21/h5-9,12-13,20,23H,10-11,14-15H2,1-4H3,(H,34,39)(H,33,35,36)/t20?,23-/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134206 (US8846689, 208) Show SMILES CO[C@@H]1CN(C)CCC1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4c3C(=O)N(C)C4(C)C)n2)cc1C |r| Show InChI InChI=1S/C31H37ClN6O5/c1-17-13-22(24(41-6)14-18(17)27(39)34-21-11-12-37(4)16-25(21)42-7)35-30-33-15-20(32)28(36-30)43-23-10-8-9-19-26(23)29(40)38(5)31(19,2)3/h8-10,13-15,21,25H,11-12,16H2,1-7H3,(H,34,39)(H,33,35,36)/t21?,25-/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134207 (US8846689, 209) Show SMILES CO[C@H]1CN(C)CC[C@@H]1NC(=O)c1cc(OC)c(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)cc1F |r| Show InChI InChI=1S/C29H30F4N6O5/c1-38-9-8-19(23(14-38)43-4)35-25(40)16-10-22(42-3)20(11-18(16)30)36-28-34-12-17(29(31,32)33)26(37-28)44-21-7-5-6-15-13-39(2)27(41)24(15)21/h5-7,10-12,19,23H,8-9,13-14H2,1-4H3,(H,35,40)(H,34,36,37)/t19-,23-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134208 (US8846689, 210) Show SMILES CO[C@H]1CN(C)CC[C@@H]1NC(=O)c1ccc(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)c(OC)c1 |r| Show InChI InChI=1S/C29H31F3N6O5/c1-37-11-10-20(23(15-37)42-4)34-25(39)16-8-9-19(22(12-16)41-3)35-28-33-13-18(29(30,31)32)26(36-28)43-21-7-5-6-17-14-38(2)27(40)24(17)21/h5-9,12-13,20,23H,10-11,14-15H2,1-4H3,(H,34,39)(H,33,35,36)/t20-,23-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134209 (US8846689, 211) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)C#CCN(C)C Show InChI InChI=1S/C26H24F3N5O3/c1-33(2)12-6-7-16-10-11-19(21(13-16)36-4)31-25-30-14-18(26(27,28)29)23(32-25)37-20-9-5-8-17-15-34(3)24(35)22(17)20/h5,8-11,13-14H,12,15H2,1-4H3,(H,30,31,32)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134210 (US8846689, 212) Show SMILES CO[C@@H]1CN(C)CC[C@H]1NC(=O)c1cc(OC)c(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)cc1C |r| Show InChI InChI=1S/C30H33F3N6O5/c1-16-11-21(23(42-4)12-18(16)26(40)35-20-9-10-38(2)15-24(20)43-5)36-29-34-13-19(30(31,32)33)27(37-29)44-22-8-6-7-17-14-39(3)28(41)25(17)22/h6-8,11-13,20,24H,9-10,14-15H2,1-5H3,(H,35,40)(H,34,36,37)/t20-,24-/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134211 (US8846689, 213) Show SMILES CO[C@H]1CN(C)CC[C@@H]1NC(=O)c1cc(OC)c(Nc2ncc(c(Oc3cccc4CN(C)C(=O)c34)n2)C(F)(F)F)cc1C |r| Show InChI InChI=1S/C30H33F3N6O5/c1-16-11-21(23(42-4)12-18(16)26(40)35-20-9-10-38(2)15-24(20)43-5)36-29-34-13-19(30(31,32)33)27(37-29)44-22-8-6-7-17-14-39(3)28(41)25(17)22/h6-8,11-13,20,24H,9-10,14-15H2,1-5H3,(H,35,40)(H,34,36,37)/t20-,24-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134036 (US8846689, 38) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)C(=O)NC1CCN(C)CC1 Show InChI InChI=1S/C28H29F3N6O4/c1-36-11-9-18(10-12-36)33-24(38)16-7-8-20(22(13-16)40-3)34-27-32-14-19(28(29,30)31)25(35-27)41-21-6-4-5-17-15-37(2)26(39)23(17)21/h4-8,13-14,18H,9-12,15H2,1-3H3,(H,33,38)(H,32,34,35)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM10180 (US8846689, 156) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3C(C)C(C)C(=O)c23)n1 |r| Show InChI InChI=1S/C29H30Cl2FN5O4/c1-14-15(2)26(38)25-16(14)6-5-7-23(25)41-28-19(31)12-33-29(36-28)35-22-11-18(30)17(10-24(22)40-4)27(39)34-21-8-9-37(3)13-20(21)32/h5-7,10-12,14-15,20-21H,8-9,13H2,1-4H3,(H,34,39)(H,33,35,36)/t14?,15?,20-,21+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134045 (US8846689, 156 | US8846689, 47) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3[C@H](C)N(C)C(=O)c23)n1 |r| Show InChI InChI=1S/C28H29Cl2FN6O4/c1-14-15-6-5-7-22(24(15)27(39)37(14)3)41-26-18(30)12-32-28(35-26)34-21-11-17(29)16(10-23(21)40-4)25(38)33-20-8-9-36(2)13-19(20)31/h5-7,10-12,14,19-20H,8-9,13H2,1-4H3,(H,33,38)(H,32,34,35)/t14-,19+,20-/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134062 (US8846689, 64) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)C(=O)N[C@@H]1CCN(C)C[C@@H]1F |r| Show InChI InChI=1S/C28H28F4N6O4/c1-37-10-9-19(18(29)14-37)34-24(39)15-7-8-20(22(11-15)41-3)35-27-33-12-17(28(30,31)32)25(36-27)42-21-6-4-5-16-13-38(2)26(40)23(16)21/h4-8,11-12,18-19H,9-10,13-14H2,1-3H3,(H,34,39)(H,33,35,36)/t18-,19+/m0/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134063 (US8846689, 65) Show SMILES COc1cc(C(=O)N[C@H]2CCN(C)C[C@H]2F)c(F)cc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F |r| Show InChI InChI=1S/C28H27F5N6O4/c1-38-8-7-19(18(30)13-38)35-24(40)15-9-22(42-3)20(10-17(15)29)36-27-34-11-16(28(31,32)33)25(37-27)43-21-6-4-5-14-12-39(2)26(41)23(14)21/h4-6,9-11,18-19H,7-8,12-13H2,1-3H3,(H,35,40)(H,34,36,37)/t18-,19+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134066 (US8846689, 68) Show SMILES COc1cc(C(=O)NC2CCN(C)CC2)c(Cl)cc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F Show InChI InChI=1S/C28H28ClF3N6O4/c1-37-9-7-16(8-10-37)34-24(39)17-11-22(41-3)20(12-19(17)29)35-27-33-13-18(28(30,31)32)25(36-27)42-21-6-4-5-15-14-38(2)26(40)23(15)21/h4-6,11-13,16H,7-10,14H2,1-3H3,(H,34,39)(H,33,35,36)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134067 (US8846689, 69) Show SMILES COc1cc(C(=O)NC2CCN(C)CC2)c(F)cc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F Show InChI InChI=1S/C28H28F4N6O4/c1-37-9-7-16(8-10-37)34-24(39)17-11-22(41-3)20(12-19(17)29)35-27-33-13-18(28(30,31)32)25(36-27)42-21-6-4-5-15-14-38(2)26(40)23(15)21/h4-6,11-13,16H,7-10,14H2,1-3H3,(H,34,39)(H,33,35,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE 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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134068 (US8846689, 70) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)C(=O)N[C@H]1CCN(C)C[C@H]1F |r| Show InChI InChI=1S/C28H28F4N6O4/c1-37-10-9-19(18(29)14-37)34-24(39)15-7-8-20(22(11-15)41-3)35-27-33-12-17(28(30,31)32)25(36-27)42-21-6-4-5-16-13-38(2)26(40)23(16)21/h4-8,11-12,18-19H,9-10,13-14H2,1-3H3,(H,34,39)(H,33,35,36)/t18-,19+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134076 (US8846689, 78) Show SMILES COc1cc(ccc1Nc1ncc(Cl)c(Oc2cccc3CN(C)C(=O)c23)n1)C(=O)NC1CCN(C)CC1 Show InChI InChI=1S/C27H29ClN6O4/c1-33-11-9-18(10-12-33)30-24(35)16-7-8-20(22(13-16)37-3)31-27-29-14-19(28)25(32-27)38-21-6-4-5-17-15-34(2)26(36)23(17)21/h4-8,13-14,18H,9-12,15H2,1-3H3,(H,30,35)(H,29,31,32)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134079 (US8846689, 81) Show SMILES CON1Cc2cccc(Oc3nc(Nc4cc(F)c(cc4OC)C(=O)NC4CCN(C)CC4)ncc3Cl)c2C1=O Show InChI InChI=1S/C27H28ClFN6O5/c1-34-9-7-16(8-10-34)31-24(36)17-11-22(38-2)20(12-19(17)29)32-27-30-13-18(28)25(33-27)40-21-6-4-5-15-14-35(39-3)26(37)23(15)21/h4-6,11-13,16H,7-10,14H2,1-3H3,(H,31,36)(H,30,32,33)	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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134086 (US8846689, 88) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3C(C)N(C)C(=O)c23)n1)C(F)(F)F)C(=O)N[C@H]1CCN(C)C[C@H]1F |r,w:20.22| Show InChI InChI=1S/C29H30F4N6O4/c1-15-17-6-5-7-22(24(17)27(41)39(15)3)43-26-18(29(31,32)33)13-34-28(37-26)36-21-9-8-16(12-23(21)42-4)25(40)35-20-10-11-38(2)14-19(20)30/h5-9,12-13,15,19-20H,10-11,14H2,1-4H3,(H,35,40)(H,34,36,37)/t15?,19-,20+/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	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134087 (US8846689, 89) Show SMILES COc1cc(ccc1Nc1ncc(Cl)c(Oc2cccc3C(C)N(C)C(=O)c23)n1)N1CCN(C)CC1 Show InChI InChI=1S/C26H29ClN6O3/c1-16-18-6-5-7-21(23(18)25(34)32(16)3)36-24-19(27)15-28-26(30-24)29-20-9-8-17(14-22(20)35-4)33-12-10-31(2)11-13-33/h5-9,14-16H,10-13H2,1-4H3,(H,28,29,30)	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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134090 (US8846689, 92) Show SMILES COc1cc(C(=O)NC2CCN(C)CC2)c(Cl)cc1Nc1ncc(Cl)c(Oc2cccc3CN(C)C(=O)c23)n1 Show InChI InChI=1S/C27H28Cl2N6O4/c1-34-9-7-16(8-10-34)31-24(36)17-11-22(38-3)20(12-18(17)28)32-27-30-13-19(29)25(33-27)39-21-6-4-5-15-14-35(2)26(37)23(15)21/h4-6,11-13,16H,7-10,14H2,1-3H3,(H,31,36)(H,30,32,33)	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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134091 (US8846689, 93) Show SMILES COc1cc(CN(C)C)ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F Show InChI InChI=1S/C24H24F3N5O3/c1-31(2)12-14-8-9-17(19(10-14)34-4)29-23-28-11-16(24(25,26)27)21(30-23)35-18-7-5-6-15-13-32(3)22(33)20(15)18/h5-11H,12-13H2,1-4H3,(H,28,29,30)	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
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134092 (US8846689, 94) Show SMILES COc1cc(CN2CCCC2)ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F Show InChI InChI=1S/C26H26F3N5O3/c1-33-15-17-6-5-7-20(22(17)24(33)35)37-23-18(26(27,28)29)13-30-25(32-23)31-19-9-8-16(12-21(19)36-2)14-34-10-3-4-11-34/h5-9,12-13H,3-4,10-11,14-15H2,1-2H3,(H,30,31,32)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134099 (US8846689, 101) Show SMILES COc1cc(ccc1Nc1ncc(c(Oc2cccc3CN(C)C(=O)c23)n1)C(F)(F)F)N1CCN(C)CC1 Show InChI InChI=1S/C26H27F3N6O3/c1-33-9-11-35(12-10-33)17-7-8-19(21(13-17)37-3)31-25-30-14-18(26(27,28)29)23(32-25)38-20-6-4-5-16-15-34(2)24(36)22(16)20/h4-8,13-14H,9-12,15H2,1-3H3,(H,30,31,32)	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	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
					More data for this Ligand-Target Pair

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