Compile Data Set for Download or QSAR

Found 32 hits Enz. Inhib. hit(s) with all data for entry = 1831   

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
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM342461 (US9776988, Example 21) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(CC2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C29H35N7O4/c1-38-23-15-20(16-24(19-23)39-2)3-4-21-17-27(33-32-21)28-30-25-6-5-22(18-26(25)31-28)34-7-9-35(10-8-34)29(37)36-11-13-40-14-12-36/h5-6,15-19H,3-4,7-14H2,1-2H3,(H,30,31)(H,32,33)	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	0.950	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM342487 (US9776988, Example 3) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NC2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C26H29N5O4/c1-33-20-11-16(12-21(15-20)34-2)3-5-19-14-24(31-30-19)25-28-22-6-4-17(13-23(22)29-25)26(32)27-18-7-9-35-10-8-18/h4,6,11-15,18H,3,5,7-10H2,1-2H3,(H,27,32)(H,28,29)(H,30,31)	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	1.07	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM342463 (US9776988, Example 27) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)-c2ccn(CCN3CCOCC3)n2)cc(OC)c1 Show InChI InChI=1S/C29H33N7O3/c1-37-23-15-20(16-24(19-23)38-2)3-5-22-18-28(33-32-22)29-30-26-6-4-21(17-27(26)31-29)25-7-8-36(34-25)10-9-35-11-13-39-14-12-35/h4,6-8,15-19H,3,5,9-14H2,1-2H3,(H,30,31)(H,32,33)	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	1.26	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM342456 (US9776988, Example 14) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(CN4CCN(CCN5CCOCC5)CC4)ccc3[nH]2)cc(OC)c1 Show InChI InChI=1S/C31H41N7O3/c1-39-26-17-23(18-27(21-26)40-2)3-5-25-20-30(35-34-25)31-32-28-6-4-24(19-29(28)33-31)22-38-11-9-36(10-12-38)7-8-37-13-15-41-16-14-37/h4,6,17-21H,3,5,7-16,22H2,1-2H3,(H,32,33)(H,34,35)	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	1.63	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM339992 (US9776988, Example 18) Show SMILES CCN1CCN(CC1)c1ccc2[nH]c(nc2c1)-c1cc(CCc2cc(OC)cc(OC)c2)[nH]n1 Show InChI InChI=1S/C26H32N6O2/c1-4-31-9-11-32(12-10-31)20-7-8-23-24(16-20)28-26(27-23)25-15-19(29-30-25)6-5-18-13-21(33-2)17-22(14-18)34-3/h7-8,13-17H,4-6,9-12H2,1-3H3,(H,27,28)(H,29,30)	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	2.05	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM340025 (US9776988, Example 8) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCN(C)CC2)cc(OC)c1 Show InChI InChI=1S/C26H30N6O3/c1-31-8-10-32(11-9-31)26(33)18-5-7-22-23(14-18)28-25(27-22)24-15-19(29-30-24)6-4-17-12-20(34-2)16-21(13-17)35-3/h5,7,12-16H,4,6,8-11H2,1-3H3,(H,27,28)(H,29,30)	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	2.13	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM342472 (US9776988, Example 4) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NCCN2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C27H32N6O4/c1-35-21-13-18(14-22(17-21)36-2)3-5-20-16-25(32-31-20)26-29-23-6-4-19(15-24(23)30-26)27(34)28-7-8-33-9-11-37-12-10-33/h4,6,13-17H,3,5,7-12H2,1-2H3,(H,28,34)(H,29,30)(H,31,32)	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	2.18	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 2 (Homo sapiens (Human))	BDBM340013 (US9776988, Example 2) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C25H27N5O4/c1-32-19-11-16(12-20(15-19)33-2)3-5-18-14-23(29-28-18)24-26-21-6-4-17(13-22(21)27-24)25(31)30-7-9-34-10-8-30/h4,6,11-15H,3,5,7-10H2,1-2H3,(H,26,27)(H,28,29)	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	2.19	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM342461 (US9776988, Example 21) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(CC2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C29H35N7O4/c1-38-23-15-20(16-24(19-23)39-2)3-4-21-17-27(33-32-21)28-30-25-6-5-22(18-26(25)31-28)34-7-9-35(10-8-34)29(37)36-11-13-40-14-12-36/h5-6,15-19H,3-4,7-14H2,1-2H3,(H,30,31)(H,32,33)	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	3.52	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM339992 (US9776988, Example 18) Show SMILES CCN1CCN(CC1)c1ccc2[nH]c(nc2c1)-c1cc(CCc2cc(OC)cc(OC)c2)[nH]n1 Show InChI InChI=1S/C26H32N6O2/c1-4-31-9-11-32(12-10-31)20-7-8-23-24(16-20)28-26(27-23)25-15-19(29-30-25)6-5-18-13-21(33-2)17-22(14-18)34-3/h7-8,13-17H,4-6,9-12H2,1-3H3,(H,27,28)(H,29,30)	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	4.72	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM342463 (US9776988, Example 27) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)-c2ccn(CCN3CCOCC3)n2)cc(OC)c1 Show InChI InChI=1S/C29H33N7O3/c1-37-23-15-20(16-24(19-23)38-2)3-5-22-18-28(33-32-22)29-30-26-6-4-21(17-27(26)31-29)25-7-8-36(34-25)10-9-35-11-13-39-14-12-35/h4,6-8,15-19H,3,5,9-14H2,1-2H3,(H,30,31)(H,32,33)	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	6.54	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM340013 (US9776988, Example 2) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C25H27N5O4/c1-32-19-11-16(12-20(15-19)33-2)3-5-18-14-23(29-28-18)24-26-21-6-4-17(13-22(21)27-24)25(31)30-7-9-34-10-8-30/h4,6,11-15H,3,5,7-10H2,1-2H3,(H,26,27)(H,28,29)	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	7.80	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM339992 (US9776988, Example 18) Show SMILES CCN1CCN(CC1)c1ccc2[nH]c(nc2c1)-c1cc(CCc2cc(OC)cc(OC)c2)[nH]n1 Show InChI InChI=1S/C26H32N6O2/c1-4-31-9-11-32(12-10-31)20-7-8-23-24(16-20)28-26(27-23)25-15-19(29-30-25)6-5-18-13-21(33-2)17-22(14-18)34-3/h7-8,13-17H,4-6,9-12H2,1-3H3,(H,27,28)(H,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.65	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM340025 (US9776988, Example 8) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCN(C)CC2)cc(OC)c1 Show InChI InChI=1S/C26H30N6O3/c1-31-8-10-32(11-9-31)26(33)18-5-7-22-23(14-18)28-25(27-22)24-15-19(29-30-24)6-4-17-12-20(34-2)16-21(13-17)35-3/h5,7,12-16H,4,6,8-11H2,1-3H3,(H,27,28)(H,29,30)	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	9.65	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM342461 (US9776988, Example 21) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(CC2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C29H35N7O4/c1-38-23-15-20(16-24(19-23)39-2)3-4-21-17-27(33-32-21)28-30-25-6-5-22(18-26(25)31-28)34-7-9-35(10-8-34)29(37)36-11-13-40-14-12-36/h5-6,15-19H,3-4,7-14H2,1-2H3,(H,30,31)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10.5	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM342487 (US9776988, Example 3) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NC2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C26H29N5O4/c1-33-20-11-16(12-21(15-20)34-2)3-5-19-14-24(31-30-19)25-28-22-6-4-17(13-23(22)29-25)26(32)27-18-7-9-35-10-8-18/h4,6,11-15,18H,3,5,7-10H2,1-2H3,(H,27,32)(H,28,29)(H,30,31)	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	11.3	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM342472 (US9776988, Example 4) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NCCN2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C27H32N6O4/c1-35-21-13-18(14-22(17-21)36-2)3-5-20-16-25(32-31-20)26-29-23-6-4-19(15-24(23)30-26)27(34)28-7-8-33-9-11-37-12-10-33/h4,6,13-17H,3,5,7-12H2,1-2H3,(H,28,34)(H,29,30)(H,31,32)	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	11.3	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM342456 (US9776988, Example 14) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(CN4CCN(CCN5CCOCC5)CC4)ccc3[nH]2)cc(OC)c1 Show InChI InChI=1S/C31H41N7O3/c1-39-26-17-23(18-27(21-26)40-2)3-5-25-20-30(35-34-25)31-32-28-6-4-24(19-29(28)33-31)22-38-11-9-36(10-12-38)7-8-37-13-15-41-16-14-37/h4,6,17-21H,3,5,7-16,22H2,1-2H3,(H,32,33)(H,34,35)	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	16	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM342463 (US9776988, Example 27) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)-c2ccn(CCN3CCOCC3)n2)cc(OC)c1 Show InChI InChI=1S/C29H33N7O3/c1-37-23-15-20(16-24(19-23)38-2)3-5-22-18-28(33-32-22)29-30-26-6-4-21(17-27(26)31-29)25-7-8-36(34-25)10-9-35-11-13-39-14-12-35/h4,6-8,15-19H,3,5,9-14H2,1-2H3,(H,30,31)(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	17.8	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM340025 (US9776988, Example 8) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCN(C)CC2)cc(OC)c1 Show InChI InChI=1S/C26H30N6O3/c1-31-8-10-32(11-9-31)26(33)18-5-7-22-23(14-18)28-25(27-22)24-15-19(29-30-24)6-4-17-12-20(34-2)16-21(13-17)35-3/h5,7,12-16H,4,6,8-11H2,1-3H3,(H,27,28)(H,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	22.2	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM340013 (US9776988, Example 2) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C25H27N5O4/c1-32-19-11-16(12-20(15-19)33-2)3-5-18-14-23(29-28-18)24-26-21-6-4-17(13-22(21)27-24)25(31)30-7-9-34-10-8-30/h4,6,11-15H,3,5,7-10H2,1-2H3,(H,26,27)(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25.3	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM342472 (US9776988, Example 4) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NCCN2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C27H32N6O4/c1-35-21-13-18(14-22(17-21)36-2)3-5-20-16-25(32-31-20)26-29-23-6-4-19(15-24(23)30-26)27(34)28-7-8-33-9-11-37-12-10-33/h4,6,13-17H,3,5,7-12H2,1-2H3,(H,28,34)(H,29,30)(H,31,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	29.8	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM342456 (US9776988, Example 14) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(CN4CCN(CCN5CCOCC5)CC4)ccc3[nH]2)cc(OC)c1 Show InChI InChI=1S/C31H41N7O3/c1-39-26-17-23(18-27(21-26)40-2)3-5-25-20-30(35-34-25)31-32-28-6-4-24(19-29(28)33-31)22-38-11-9-36(10-12-38)7-8-37-13-15-41-16-14-37/h4,6,17-21H,3,5,7-16,22H2,1-2H3,(H,32,33)(H,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	33.1	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 3 (Homo sapiens (Human))	BDBM342487 (US9776988, Example 3) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NC2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C26H29N5O4/c1-33-20-11-16(12-21(15-20)34-2)3-5-19-14-24(31-30-19)25-28-22-6-4-17(13-23(22)29-25)26(32)27-18-7-9-35-10-8-18/h4,6,11-15,18H,3,5,7-10H2,1-2H3,(H,27,32)(H,28,29)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40.5	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM342461 (US9776988, Example 21) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(CC2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C29H35N7O4/c1-38-23-15-20(16-24(19-23)39-2)3-4-21-17-27(33-32-21)28-30-25-6-5-22(18-26(25)31-28)34-7-9-35(10-8-34)29(37)36-11-13-40-14-12-36/h5-6,15-19H,3-4,7-14H2,1-2H3,(H,30,31)(H,32,33)	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	44	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM342487 (US9776988, Example 3) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NC2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C26H29N5O4/c1-33-20-11-16(12-21(15-20)34-2)3-5-19-14-24(31-30-19)25-28-22-6-4-17(13-23(22)29-25)26(32)27-18-7-9-35-10-8-18/h4,6,11-15,18H,3,5,7-10H2,1-2H3,(H,27,32)(H,28,29)(H,30,31)	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	70.4	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM340025 (US9776988, Example 8) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCN(C)CC2)cc(OC)c1 Show InChI InChI=1S/C26H30N6O3/c1-31-8-10-32(11-9-31)26(33)18-5-7-22-23(14-18)28-25(27-22)24-15-19(29-30-24)6-4-17-12-20(34-2)16-21(13-17)35-3/h5,7,12-16H,4,6,8-11H2,1-3H3,(H,27,28)(H,29,30)	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	79.3	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM339992 (US9776988, Example 18) Show SMILES CCN1CCN(CC1)c1ccc2[nH]c(nc2c1)-c1cc(CCc2cc(OC)cc(OC)c2)[nH]n1 Show InChI InChI=1S/C26H32N6O2/c1-4-31-9-11-32(12-10-31)20-7-8-23-24(16-20)28-26(27-23)25-15-19(29-30-25)6-5-18-13-21(33-2)17-22(14-18)34-3/h7-8,13-17H,4-6,9-12H2,1-3H3,(H,27,28)(H,29,30)	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	81.6	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM342472 (US9776988, Example 4) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NCCN2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C27H32N6O4/c1-35-21-13-18(14-22(17-21)36-2)3-5-20-16-25(32-31-20)26-29-23-6-4-19(15-24(23)30-26)27(34)28-7-8-33-9-11-37-12-10-33/h4,6,13-17H,3,5,7-12H2,1-2H3,(H,28,34)(H,29,30)(H,31,32)	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	82.9	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM342463 (US9776988, Example 27) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)-c2ccn(CCN3CCOCC3)n2)cc(OC)c1 Show InChI InChI=1S/C29H33N7O3/c1-37-23-15-20(16-24(19-23)38-2)3-5-22-18-28(33-32-22)29-30-26-6-4-21(17-27(26)31-29)25-7-8-36(34-25)10-9-35-11-13-39-14-12-35/h4,6-8,15-19H,3,5,9-14H2,1-2H3,(H,30,31)(H,32,33)	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	88.1	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM340013 (US9776988, Example 2) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCOCC2)cc(OC)c1 Show InChI InChI=1S/C25H27N5O4/c1-32-19-11-16(12-20(15-19)33-2)3-5-18-14-23(29-28-18)24-26-21-6-4-17(13-22(21)27-24)25(31)30-7-9-34-10-8-30/h4,6,11-15H,3,5,7-10H2,1-2H3,(H,26,27)(H,28,29)	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	114	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM342456 (US9776988, Example 14) Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(CN4CCN(CCN5CCOCC5)CC4)ccc3[nH]2)cc(OC)c1 Show InChI InChI=1S/C31H41N7O3/c1-39-26-17-23(18-27(21-26)40-2)3-5-25-20-30(35-34-25)31-32-28-6-4-24(19-29(28)33-31)22-38-11-9-36(10-12-38)7-8-37-13-15-41-16-14-37/h4,6,17-21H,3,5,7-16,22H2,1-2H3,(H,32,33)(H,34,35)	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	125	n/a	n/a	n/a	n/a	n/a	n/a
Celon Pharma S.A. US Patent					Assay Description The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...				US Patent US9776988 (2017) BindingDB Entry DOI: 10.7270/Q27946S6
					More data for this Ligand-Target Pair