Compile Data Set for Download or QSAR

Found 122 hits with Last Name = 'wakao' and Initial = 'm'   

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
Isoform 1 of Fibronectin (1) (Homo sapiens (Human))	BDBM50375222 (CHEMBL256614) Show SMILES CO[C@@H]1[C@@H](CO)O[C@H](O[C@H]2[C@H](O)[C@@H](OS([O-])(=O)=O)[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H]2C([O-])=O)[C@H](NS([O-])(=O)=O)[C@H]1O Show InChI InChI=1S/C33H53N3O22S4/c1-53-27-20(13-37)55-32(22(25(27)43)36-61(47,48)49)56-28-26(44)29(58-62(50,51)52)33(57-30(28)31(45)46)54-14-19(39)24(42)23(41)18(38)12-34-15-5-4-6-16(11-15)35-21(40)8-3-2-7-17-9-10-59-60-17/h4-6,11,17-20,22-30,32-34,36-39,41-44H,2-3,7-10,12-14H2,1H3,(H,35,40)(H,45,46)(H,47,48,49)(H,50,51,52)/p-3/t17?,18-,19+,20+,22+,23+,24+,25+,26-,27+,28-,29+,30+,32+,33+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to fibronectin using surface plasmon resonance imaging sensor method				Bioorg Med Chem Lett 18: 2499-504 (2008) Article DOI: 10.1016/j.bmcl.2008.01.069 BindingDB Entry DOI: 10.7270/Q2FF3T6W
					More data for this Ligand-Target Pair
Isoform 1 of Fibronectin (1) (Homo sapiens (Human))	BDBM50375224 (CHEMBL441895) Show SMILES CO[C@H]1[C@H](O)[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@@H]2C([O-])=O)O[C@@H]1COS([O-])(=O)=O |w:39.38| Show InChI InChI=1S/C33H53N3O19S3/c1-50-28-20(14-52-58(47,48)49)53-32(22(34)25(28)42)54-29-26(43)27(44)33(55-30(29)31(45)46)51-13-19(38)24(41)23(40)18(37)12-35-15-5-4-6-16(11-15)36-21(39)8-3-2-7-17-9-10-56-57-17/h4-6,11,17-20,22-30,32-33,35,37-38,40-44H,2-3,7-10,12-14,34H2,1H3,(H,36,39)(H,45,46)(H,47,48,49)/p-2/t17?,18-,19+,20+,22+,23+,24+,25+,26+,27+,28+,29-,30-,32+,33+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to fibronectin using surface plasmon resonance imaging sensor method				Bioorg Med Chem Lett 18: 2499-504 (2008) Article DOI: 10.1016/j.bmcl.2008.01.069 BindingDB Entry DOI: 10.7270/Q2FF3T6W
					More data for this Ligand-Target Pair
Isoform 1 of Fibronectin (1) (Homo sapiens (Human))	BDBM50375221 (CHEMBL404104) Show SMILES CO[C@@H]1[C@@H](COS([O-])(=O)=O)O[C@H](O[C@H]2[C@H](O)[C@@H](OS([O-])(=O)=O)[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H]2C([O-])=O)[C@H](NS([O-])(=O)=O)[C@H]1O Show InChI InChI=1S/C33H53N3O25S5/c1-55-27-20(14-57-65(49,50)51)58-32(22(25(27)42)36-64(46,47)48)59-28-26(43)29(61-66(52,53)54)33(60-30(28)31(44)45)56-13-19(38)24(41)23(40)18(37)12-34-15-5-4-6-16(11-15)35-21(39)8-3-2-7-17-9-10-62-63-17/h4-6,11,17-20,22-30,32-34,36-38,40-43H,2-3,7-10,12-14H2,1H3,(H,35,39)(H,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54)/p-4/t17?,18-,19+,20+,22+,23+,24+,25+,26-,27+,28-,29+,30+,32+,33+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.5	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to fibronectin using surface plasmon resonance imaging sensor method				Bioorg Med Chem Lett 18: 2499-504 (2008) Article DOI: 10.1016/j.bmcl.2008.01.069 BindingDB Entry DOI: 10.7270/Q2FF3T6W
					More data for this Ligand-Target Pair
Isoform 1 of Fibronectin (1) (Homo sapiens (Human))	BDBM50375223 (CHEMBL404103) Show SMILES CO[C@@H]1[C@@H](COS([O-])(=O)=O)O[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@@H]2C([O-])=O)[C@H](NS([O-])(=O)=O)[C@H]1O Show InChI InChI=1S/C33H53N3O22S4/c1-53-28-20(14-55-62(50,51)52)56-32(22(25(28)42)36-61(47,48)49)57-29-26(43)27(44)33(58-30(29)31(45)46)54-13-19(38)24(41)23(40)18(37)12-34-15-5-4-6-16(11-15)35-21(39)8-3-2-7-17-9-10-59-60-17/h4-6,11,17-20,22-30,32-34,36-38,40-44H,2-3,7-10,12-14H2,1H3,(H,35,39)(H,45,46)(H,47,48,49)(H,50,51,52)/p-3/t17?,18-,19+,20+,22+,23+,24+,25+,26+,27+,28+,29-,30-,32+,33+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	6.5	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to fibronectin using surface plasmon resonance imaging sensor method				Bioorg Med Chem Lett 18: 2499-504 (2008) Article DOI: 10.1016/j.bmcl.2008.01.069 BindingDB Entry DOI: 10.7270/Q2FF3T6W
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063776 (CHEMBL3397498) Show SMILES [Na+].[Na+].[Na+].[Na+].[Na+].[H][C@@]1(O[C@@H]2[C@@H](NC(C)=O)[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H](COS([O-])(=O)=O)[C@@H]2OS([O-])(=O)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O29S6.5Na/c1-15(38)36-23-28(62-34-31(66-72(56,57)58)29(65-71(53,54)55)26(44)30(63-34)32(45)46)27(64-70(50,51)52)21(14-60-69(47,48)49)61-33(23)59-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-67-68-18;;;;;/h4-6,11,18-21,23-31,33-35,39-40,42-44H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,45,46)(H,47,48,49)(H,50,51,52)(H,53,54,55)(H,56,57,58);;;;;/q;5*+1/p-5/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28+,29-,30-,31+,33-,34+;;;;;/m0...../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.90	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063808 (CHEMBL3397497) Show SMILES [Na+].[Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](COS([O-])(=O)=O)O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O26S5.4Na/c1-15(38)36-23-28(60-34-31(63-68(54,55)56)29(62-67(51,52)53)27(45)30(61-34)32(46)47)26(44)21(14-58-66(48,49)50)59-33(23)57-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-64-65-18;;;;/h4-6,11,18-21,23-31,33-35,39-40,42-45H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;/q;4*+1/p-4/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28+,29-,30-,31+,33-,34+;;;;/m0..../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	99	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063810 (CHEMBL3397496) Show SMILES [Na+].[Na+].[Na+].[Na+].[H][C@@]1(O[C@@H]2[C@@H](NC(C)=O)[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H](CO)[C@@H]2OS([O-])(=O)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O26S5.4Na/c1-15(39)36-23-28(59-34-31(63-68(54,55)56)29(62-67(51,52)53)26(45)30(60-34)32(46)47)27(61-66(48,49)50)21(13-38)58-33(23)57-14-20(41)25(44)24(43)19(40)12-35-16-5-4-6-17(11-16)37-22(42)8-3-2-7-18-9-10-64-65-18;;;;/h4-6,11,18-21,23-31,33-35,38,40-41,43-45H,2-3,7-10,12-14H2,1H3,(H,36,39)(H,37,42)(H,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;/q;4*+1/p-4/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28+,29-,30-,31+,33-,34+;;;;/m0..../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063812 (CHEMBL3397495) Show SMILES [Na+].[Na+].[Na+].[Na+].[H][C@@]1(O[C@@H]2[C@@H](NC(C)=O)[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H](COS([O-])(=O)=O)[C@@H]2OS([O-])(=O)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O26S5.4Na/c1-15(38)36-23-29(60-34-27(45)30(63-68(54,55)56)26(44)31(61-34)32(46)47)28(62-67(51,52)53)21(14-58-66(48,49)50)59-33(23)57-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-64-65-18;;;;/h4-6,11,18-21,23-31,33-35,39-40,42-45H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;/q;4*+1/p-4/t18?,19-,20+,21+,23+,24+,25+,26-,27+,28-,29+,30-,31-,33-,34+;;;;/m0..../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063824 (CHEMBL3397494) Show SMILES [Na+].[Na+].[Na+].[Na+].[H][C@@]1(O[C@@H]2[C@@H](NC(C)=O)[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H](COS([O-])(=O)=O)[C@@H]2OS([O-])(=O)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O26S5.4Na/c1-15(38)36-23-29(60-34-31(63-68(54,55)56)27(45)26(44)30(61-34)32(46)47)28(62-67(51,52)53)21(14-58-66(48,49)50)59-33(23)57-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-64-65-18;;;;/h4-6,11,18-21,23-31,33-35,39-40,42-45H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56);;;;/q;4*+1/p-4/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28-,29+,30-,31+,33-,34+;;;;/m0..../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063835 (CHEMBL3397493) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](CO)O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O23S4.3Na/c1-15(39)36-23-28(57-34-31(60-64(52,53)54)29(59-63(49,50)51)27(46)30(58-34)32(47)48)26(45)21(13-38)56-33(23)55-14-20(41)25(44)24(43)19(40)12-35-16-5-4-6-17(11-16)37-22(42)8-3-2-7-18-9-10-61-62-18;;;/h4-6,11,18-21,23-31,33-35,38,40-41,43-46H,2-3,7-10,12-14H2,1H3,(H,36,39)(H,37,42)(H,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28+,29-,30-,31+,33-,34+;;;/m0.../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063837 (CHEMBL3397492) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](COS([O-])(=O)=O)O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O23S4.3Na/c1-15(38)36-23-29(58-34-28(46)30(60-64(52,53)54)27(45)31(59-34)32(47)48)26(44)21(14-56-63(49,50)51)57-33(23)55-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-61-62-18;;;/h4-6,11,18-21,23-31,33-35,39-40,42-46H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28+,29+,30-,31-,33-,34+;;;/m0.../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	147	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063843 (CHEMBL3397491) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](COS([O-])(=O)=O)O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O23S4.3Na/c1-15(38)36-23-29(58-34-31(60-64(52,53)54)28(46)27(45)30(59-34)32(47)48)26(44)21(14-56-63(49,50)51)57-33(23)55-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-61-62-18;;;/h4-6,11,18-21,23-31,33-35,39-40,42-46H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28-,29+,30-,31+,33-,34+;;;/m0.../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063844 (CHEMBL3397490) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@@H]2[C@@H](NC(C)=O)[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H](CO)[C@@H]2OS([O-])(=O)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O23S4.3Na/c1-15(39)36-23-29(57-34-27(46)30(60-64(52,53)54)26(45)31(58-34)32(47)48)28(59-63(49,50)51)21(13-38)56-33(23)55-14-20(41)25(44)24(43)19(40)12-35-16-5-4-6-17(11-16)37-22(42)8-3-2-7-18-9-10-61-62-18;;;/h4-6,11,18-21,23-31,33-35,38,40-41,43-46H,2-3,7-10,12-14H2,1H3,(H,36,39)(H,37,42)(H,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/t18?,19-,20+,21+,23+,24+,25+,26-,27+,28-,29+,30-,31-,33-,34+;;;/m0.../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063846 (CHEMBL3397489) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@@H]2[C@@H](NC(C)=O)[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H](CO)[C@@H]2OS([O-])(=O)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O23S4.3Na/c1-15(39)36-23-29(57-34-31(60-64(52,53)54)27(46)26(45)30(58-34)32(47)48)28(59-63(49,50)51)21(13-38)56-33(23)55-14-20(41)25(44)24(43)19(40)12-35-16-5-4-6-17(11-16)37-22(42)8-3-2-7-18-9-10-61-62-18;;;/h4-6,11,18-21,23-31,33-35,38,40-41,43-46H,2-3,7-10,12-14H2,1H3,(H,36,39)(H,37,42)(H,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28-,29+,30-,31+,33-,34+;;;/m0.../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063847 (CHEMBL3397488) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@@H]2[C@@H](NC(C)=O)[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)O[C@H](COS([O-])(=O)=O)[C@@H]2OS([O-])(=O)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O23S4.3Na/c1-15(38)36-23-30(58-34-28(46)26(44)27(45)31(59-34)32(47)48)29(60-64(52,53)54)21(14-56-63(49,50)51)57-33(23)55-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-61-62-18;;;/h4-6,11,18-21,23-31,33-35,39-40,42-46H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,47,48)(H,49,50,51)(H,52,53,54);;;/q;3*+1/p-3/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28+,29-,30+,31-,33-,34+;;;/m0.../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063848 (CHEMBL3397487) Show SMILES [Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](CO)O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](OS([O-])(=O)=O)[C@H]1O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O20S3.2Na/c1-15(39)36-23-29(55-34-28(47)30(57-60(50,51)52)27(46)31(56-34)32(48)49)26(45)21(13-38)54-33(23)53-14-20(41)25(44)24(43)19(40)12-35-16-5-4-6-17(11-16)37-22(42)8-3-2-7-18-9-10-58-59-18;;/h4-6,11,18-21,23-31,33-35,38,40-41,43-47H,2-3,7-10,12-14H2,1H3,(H,36,39)(H,37,42)(H,48,49)(H,50,51,52);;/q;2*+1/p-2/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28+,29+,30-,31-,33-,34+;;/m0../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063849 (CHEMBL3397486) Show SMILES [Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](CO)O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1OS([O-])(=O)=O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O20S3.2Na/c1-15(39)36-23-29(55-34-31(57-60(50,51)52)28(47)27(46)30(56-34)32(48)49)26(45)21(13-38)54-33(23)53-14-20(41)25(44)24(43)19(40)12-35-16-5-4-6-17(11-16)37-22(42)8-3-2-7-18-9-10-58-59-18;;/h4-6,11,18-21,23-31,33-35,38,40-41,43-47H,2-3,7-10,12-14H2,1H3,(H,36,39)(H,37,42)(H,48,49)(H,50,51,52);;/q;2*+1/p-2/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28-,29+,30-,31+,33-,34+;;/m0../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50063850 (CHEMBL3397485) Show SMILES [Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](COS([O-])(=O)=O)O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C([O-])=O |r| Show InChI InChI=1S/C34H53N3O20S3.2Na/c1-15(38)36-23-30(56-34-29(47)27(45)28(46)31(57-34)32(48)49)26(44)21(14-54-60(50,51)52)55-33(23)53-13-20(40)25(43)24(42)19(39)12-35-16-5-4-6-17(11-16)37-22(41)8-3-2-7-18-9-10-58-59-18;;/h4-6,11,18-21,23-31,33-35,39-40,42-47H,2-3,7-10,12-14H2,1H3,(H,36,38)(H,37,41)(H,48,49)(H,50,51,52);;/q;2*+1/p-2/t18?,19-,20+,21+,23+,24+,25+,26-,27-,28-,29+,30+,31-,33-,34+;;/m0../s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to basic fibroblast growth factor (unknown origin) using sugar chip immobilized compound by surface plasmon resonance method				Bioorg Med Chem Lett 25: 1407-11 (2015) Article DOI: 10.1016/j.bmcl.2015.02.054 BindingDB Entry DOI: 10.7270/Q2FB54N5
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50073747 (CHEMBL3409457) Show SMILES [Na+].[Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](OS([O-])(=O)=O)[C@@H](COS([O-])(=O)=O)O[C@@]([H])(O[C@H]3[C@H](O)[C@@H](O)[C@]([H])(O[C@@H]4[C@@H](NC(C)=O)[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc5cccc(NC(=O)CCCCC6CCSS6)c5)O[C@H](COS([O-])(=O)=O)[C@@H]4OS([O-])(=O)=O)O[C@@H]3C(O)=O)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O |r| Show InChI InChI=1S/C48H74N4O40S6/c1-17(53)50-27-38(36(91-97(75,76)77)24(15-82-95(69,70)71)84-45(27)81-14-23(56)30(59)29(58)22(55)13-49-19-6-5-7-20(12-19)52-26(57)9-4-3-8-21-10-11-93-94-21)86-48-35(64)33(62)40(42(90-48)44(67)68)88-46-28(51-18(2)54)39(87-47-34(63)31(60)32(61)41(89-47)43(65)66)37(92-98(78,79)80)25(85-46)16-83-96(72,73)74/h5-7,12,21-25,27-42,45-49,55-56,58-64H,3-4,8-11,13-16H2,1-2H3,(H,50,53)(H,51,54)(H,52,57)(H,65,66)(H,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/p-4/t21?,22-,23+,24+,25+,27+,28+,29+,30+,31-,32-,33+,34+,35+,36-,37-,38+,39+,40-,41-,42-,45+,46-,47+,48+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.20	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to FGF2 (unknown origin) assessed as change in luminance intensity at at 25 degC by SPR imaging sensor method				Bioorg Med Chem Lett 25: 1552-5 (2015) Article DOI: 10.1016/j.bmcl.2015.02.011 BindingDB Entry DOI: 10.7270/Q2Z89F4N
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50073748 (CHEMBL3559508) Show SMILES [H][C@@]1(O[C@H]2[C@@H](OS(O)(=O)=O)[C@@H](COS(O)(=O)=O)O[C@@]([H])(O[C@H]3[C@H](O)[C@@H](OS(O)(=O)=O)[C@]([H])(O[C@H]4[C@@H](O)[C@@H](COS(O)(=O)=O)O[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc5cccc(NC(=O)CCCCC6CCSS6)c5)[C@@H]4NC(C)=O)O[C@@H]3C(O)=O)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O |r| Show InChI InChI=1S/C48H74N4O40S6/c1-17(53)50-27-37(31(60)24(15-82-95(69,70)71)84-45(27)81-14-23(56)30(59)29(58)22(55)13-49-19-6-5-7-20(12-19)52-26(57)9-4-3-8-21-10-11-93-94-21)86-48-41(92-98(78,79)80)35(64)39(42(90-48)44(67)68)88-46-28(51-18(2)54)38(87-47-34(63)32(61)33(62)40(89-47)43(65)66)36(91-97(75,76)77)25(85-46)16-83-96(72,73)74/h5-7,12,21-25,27-42,45-49,55-56,58-64H,3-4,8-11,13-16H2,1-2H3,(H,50,53)(H,51,54)(H,52,57)(H,65,66)(H,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/t21?,22-,23+,24+,25+,27+,28+,29+,30+,31-,32-,33-,34+,35-,36-,37+,38+,39-,40-,41+,42-,45+,46-,47+,48+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.70	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to FGF2 (unknown origin) assessed as change in luminance intensity at at 25 degC by SPR imaging sensor method				Bioorg Med Chem Lett 25: 1552-5 (2015) Article DOI: 10.1016/j.bmcl.2015.02.011 BindingDB Entry DOI: 10.7270/Q2Z89F4N
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50073749 (CHEMBL3409455) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](O)[C@@H](COS([O-])(=O)=O)O[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc3cccc(NC(=O)CCCCC4CCSS4)c3)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O[C@]2([H])O[C@H](COS([O-])(=O)=O)[C@H](OS([O-])(=O)=O)[C@H](O[C@]3([H])O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)[C@H]2NC(C)=O)[C@H](O)[C@H]1O)C(O)=O |r| Show InChI InChI=1S/C48H74N4O37S5/c1-17(53)50-27-38(31(60)24(15-80-92(70,71)72)82-45(27)79-14-23(56)30(59)29(58)22(55)13-49-19-6-5-7-20(12-19)52-26(57)9-4-3-8-21-10-11-90-91-21)84-48-36(65)34(63)40(42(88-48)44(68)69)86-46-28(51-18(2)54)39(85-47-35(64)32(61)33(62)41(87-47)43(66)67)37(89-94(76,77)78)25(83-46)16-81-93(73,74)75/h5-7,12,21-25,27-42,45-49,55-56,58-65H,3-4,8-11,13-16H2,1-2H3,(H,50,53)(H,51,54)(H,52,57)(H,66,67)(H,68,69)(H,70,71,72)(H,73,74,75)(H,76,77,78)/p-3/t21?,22-,23+,24+,25+,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37-,38+,39+,40-,41-,42-,45+,46-,47+,48+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	8.20	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to FGF2 (unknown origin) assessed as change in luminance intensity at at 25 degC by SPR imaging sensor method				Bioorg Med Chem Lett 25: 1552-5 (2015) Article DOI: 10.1016/j.bmcl.2015.02.011 BindingDB Entry DOI: 10.7270/Q2Z89F4N
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50073750 (CHEMBL3409454) Show SMILES [Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@@H](OS([O-])(=O)=O)[C@@H](COS([O-])(=O)=O)O[C@@]([H])(O[C@H]3[C@H](O)[C@@H](O)[C@]([H])(O[C@@H]4[C@@H](NC(C)=O)[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc5cccc(NC(=O)CCCCC6CCSS6)c5)O[C@H](CO)[C@@H]4OS([O-])(=O)=O)O[C@@H]3C(O)=O)[C@@H]2NC(C)=O)O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O |r| Show InChI InChI=1S/C48H74N4O37S5/c1-17(54)50-27-38(36(88-93(73,74)75)24(14-53)81-45(27)79-15-23(57)30(60)29(59)22(56)13-49-19-6-5-7-20(12-19)52-26(58)9-4-3-8-21-10-11-90-91-21)83-48-35(65)33(63)40(42(87-48)44(68)69)85-46-28(51-18(2)55)39(84-47-34(64)31(61)32(62)41(86-47)43(66)67)37(89-94(76,77)78)25(82-46)16-80-92(70,71)72/h5-7,12,21-25,27-42,45-49,53,56-57,59-65H,3-4,8-11,13-16H2,1-2H3,(H,50,54)(H,51,55)(H,52,58)(H,66,67)(H,68,69)(H,70,71,72)(H,73,74,75)(H,76,77,78)/p-3/t21?,22-,23+,24+,25+,27+,28+,29+,30+,31-,32-,33+,34+,35+,36-,37-,38+,39+,40-,41-,42-,45+,46-,47+,48+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.60	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to FGF2 (unknown origin) assessed as change in luminance intensity at at 25 degC by SPR imaging sensor method				Bioorg Med Chem Lett 25: 1552-5 (2015) Article DOI: 10.1016/j.bmcl.2015.02.011 BindingDB Entry DOI: 10.7270/Q2Z89F4N
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50073751 (CHEMBL3409453) Show SMILES [Na+].[Na+].[Na+].[Na+].[Na+].[H][C@@]1(O[C@H]2[C@H](O)[C@@H](OS([O-])(=O)=O)[C@]([H])(O[C@@H]3[C@@H](NC(C)=O)[C@H](OCC(O)C(O)C(O)C(O)CNc4cccc(NC(=O)CCCCC5CCSS5)c4)O[C@H](COS([O-])(=O)=O)[C@@H]3OS([O-])(=O)=O)O[C@@H]2C(O)=O)O[C@H](COS([O-])(=O)=O)[C@H](O)[C@H](O[C@]2([H])O[C@@H]([C@@H](O)[C@H](O)[C@H]2OS([O-])(=O)=O)C(O)=O)[C@H]1NC(C)=O |r| Show InChI InChI=1S/C48H74N4O43S7/c1-17(53)50-27-36(88-47-40(94-101(77,78)79)33(62)32(61)39(91-47)43(64)65)31(60)24(15-84-98(68,69)70)86-46(27)90-38-34(63)41(95-102(80,81)82)48(92-42(38)44(66)67)89-37-28(51-18(2)54)45(87-25(16-85-99(71,72)73)35(37)93-100(74,75)76)83-14-23(56)30(59)29(58)22(55)13-49-19-6-5-7-20(12-19)52-26(57)9-4-3-8-21-10-11-96-97-21/h5-7,12,21-25,27-42,45-49,55-56,58-63H,3-4,8-11,13-16H2,1-2H3,(H,50,53)(H,51,54)(H,52,57)(H,64,65)(H,66,67)(H,68,69,70)(H,71,72,73)(H,74,75,76)(H,77,78,79)(H,80,81,82)/p-5/t21?,22?,23?,24-,25-,27-,28-,29?,30?,31+,32+,33+,34+,35+,36-,37-,38+,39+,40-,41-,42+,45-,46+,47-,48-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to FGF2 (unknown origin) assessed as change in luminance intensity at at 25 degC by SPR imaging sensor method				Bioorg Med Chem Lett 25: 1552-5 (2015) Article DOI: 10.1016/j.bmcl.2015.02.011 BindingDB Entry DOI: 10.7270/Q2Z89F4N
					More data for this Ligand-Target Pair
Fibroblast growth factor 2 (Homo sapiens (Human))	BDBM50073810 (CHEMBL3559507) Show SMILES [H][C@@]1(O[C@H]2[C@H](O)[C@@H](OS(O)(=O)=O)[C@]([H])(O[C@H]3[C@@H](O)[C@@H](COS(O)(=O)=O)O[C@@H](OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CNc4cccc(NC(=O)CCCCC5CCSS5)c4)[C@@H]3NC(C)=O)O[C@@H]2C(O)=O)O[C@H](COS(O)(=O)=O)[C@H](O)[C@H](O[C@]2([H])O[C@@H]([C@@H](O)[C@H](O)[C@H]2OS(O)(=O)=O)C(O)=O)[C@H]1NC(C)=O |r| Show InChI InChI=1S/C48H74N4O40S6/c1-17(53)50-27-36(31(60)24(15-82-95(69,70)71)84-45(27)81-14-23(56)30(59)29(58)22(55)13-49-19-6-5-7-20(12-19)52-26(57)9-4-3-8-21-10-11-93-94-21)86-48-41(92-98(78,79)80)35(64)38(42(90-48)44(67)68)88-46-28(51-18(2)54)37(32(61)25(85-46)16-83-96(72,73)74)87-47-40(91-97(75,76)77)34(63)33(62)39(89-47)43(65)66/h5-7,12,21-25,27-42,45-49,55-56,58-64H,3-4,8-11,13-16H2,1-2H3,(H,50,53)(H,51,54)(H,52,57)(H,65,66)(H,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)/t21?,22-,23+,24+,25+,27+,28+,29+,30+,31-,32-,33-,34-,35-,36+,37+,38-,39-,40+,41+,42-,45+,46-,47+,48+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a
Kagoshima University Curated by ChEMBL					Assay Description Binding affinity to FGF2 (unknown origin) assessed as change in luminance intensity at at 25 degC by SPR imaging sensor method				Bioorg Med Chem Lett 25: 1552-5 (2015) Article DOI: 10.1016/j.bmcl.2015.02.011 BindingDB Entry DOI: 10.7270/Q2Z89F4N
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250403 (CHEMBL2386454) Show SMILES Cn1c2ccccc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C25H26N4O2S/c1-28-20-15-9-8-14-19(20)22-23(28)24(31)29(18-12-6-3-7-13-18)25(27-22)32-16-21(30)26-17-10-4-2-5-11-17/h3,6-9,12-15,17H,2,4-5,10-11,16H2,1H3,(H,26,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	8.26E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250404 (CHEMBL4077391) Show SMILES Cn1c2ccccc2c2nc(n(-c3ccccc3)c(=O)c12)S(=O)(=O)CC(=O)NC1CCCCC1 Show InChI InChI=1S/C25H26N4O4S/c1-28-20-15-9-8-14-19(20)22-23(28)24(31)29(18-12-6-3-7-13-18)25(27-22)34(32,33)16-21(30)26-17-10-4-2-5-11-17/h3,6-9,12-15,17H,2,4-5,10-11,16H2,1H3,(H,26,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250405 (CHEMBL4065144) Show SMILES Cn1c2ccccc2c2nc(NCCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C26H29N5O2/c1-30-21-15-9-8-14-20(21)23-24(30)25(33)31(19-12-6-3-7-13-19)26(29-23)27-17-16-22(32)28-18-10-4-2-5-11-18/h3,6-9,12-15,18H,2,4-5,10-11,16-17H2,1H3,(H,27,29)(H,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250406 (CHEMBL4092815) Show SMILES Cn1c2ccccc2c2nc(OCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C25H26N4O3/c1-28-20-15-9-8-14-19(20)22-23(28)24(31)29(18-12-6-3-7-13-18)25(27-22)32-16-21(30)26-17-10-4-2-5-11-17/h3,6-9,12-15,17H,2,4-5,10-11,16H2,1H3,(H,26,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250407 (CHEMBL4085061) Show SMILES O=C(CCCSc1nc2c3ccccc3[nH]c2c(=O)n1-c1ccccc1)NC1CCCCC1 Show InChI InChI=1S/C26H28N4O2S/c31-22(27-18-10-3-1-4-11-18)16-9-17-33-26-29-23-20-14-7-8-15-21(20)28-24(23)25(32)30(26)19-12-5-2-6-13-19/h2,5-8,12-15,18,28H,1,3-4,9-11,16-17H2,(H,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250408 (CHEMBL4095263) Show SMILES O=c1n(c(SCCCC2CCCCC2)nc2c3ccccc3[nH]c12)-c1ccccc1 Show InChI InChI=1S/C25H27N3OS/c29-24-23-22(20-15-7-8-16-21(20)26-23)27-25(28(24)19-13-5-2-6-14-19)30-17-9-12-18-10-3-1-4-11-18/h2,5-8,13-16,18,26H,1,3-4,9-12,17H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250409 (CHEMBL4074812) Show SMILES O=C(CSc1nc2c3CCCCCc3[nH]c2c(=O)n1-c1ccccc1)NC1CCCCC1 Show InChI InChI=1S/C25H30N4O2S/c30-21(26-17-10-4-1-5-11-17)16-32-25-28-22-19-14-8-3-9-15-20(19)27-23(22)24(31)29(25)18-12-6-2-7-13-18/h2,6-7,12-13,17,27H,1,3-5,8-11,14-16H2,(H,26,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.42E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250410 (CHEMBL4089458) Show SMILES O=C(CSc1nc2c3CCCCc3[nH]c2c(=O)n1-c1ccccc1)NC1CCCCC1 Show InChI InChI=1S/C24H28N4O2S/c29-20(25-16-9-3-1-4-10-16)15-31-24-27-21-18-13-7-8-14-19(18)26-22(21)23(30)28(24)17-11-5-2-6-12-17/h2,5-6,11-12,16,26H,1,3-4,7-10,13-15H2,(H,25,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250411 (CHEMBL4061465) Show SMILES Cn1c2CCCCc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C25H30N4O2S/c1-28-20-15-9-8-14-19(20)22-23(28)24(31)29(18-12-6-3-7-13-18)25(27-22)32-16-21(30)26-17-10-4-2-5-11-17/h3,6-7,12-13,17H,2,4-5,8-11,14-16H2,1H3,(H,26,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250412 (CHEMBL4091234) Show SMILES Cc1c(C)c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c2n1C Show InChI InChI=1S/C23H28N4O2S/c1-15-16(2)26(3)21-20(15)25-23(27(22(21)29)18-12-8-5-9-13-18)30-14-19(28)24-17-10-6-4-7-11-17/h5,8-9,12-13,17H,4,6-7,10-11,14H2,1-3H3,(H,24,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Mus musculus)	BDBM50250413 (CHEMBL4078865) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)-c1cccc2ccccc12 Show InChI InChI=1S/C35H32N4O2S/c1-38-30-20-19-24(28-18-10-12-23-11-8-9-17-27(23)28)21-29(30)32-33(38)34(41)39(26-15-6-3-7-16-26)35(37-32)42-22-31(40)36-25-13-4-2-5-14-25/h3,6-12,15-21,25H,2,4-5,13-14,22H2,1H3,(H,36,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.58E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at mouse TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Mus musculus)	BDBM50250414 (CHEMBL4086723) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)C#C[Si](C)(C)C Show InChI InChI=1S/C30H34N4O2SSi/c1-33-25-16-15-21(17-18-38(2,3)4)19-24(25)27-28(33)29(36)34(23-13-9-6-10-14-23)30(32-27)37-20-26(35)31-22-11-7-5-8-12-22/h6,9-10,13-16,19,22H,5,7-8,11-12,20H2,1-4H3,(H,31,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at mouse TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Mus musculus)	BDBM50250415 (CHEMBL4065290) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)C#C Show InChI InChI=1S/C27H26N4O2S/c1-3-18-14-15-22-21(16-18)24-25(30(22)2)26(33)31(20-12-8-5-9-13-20)27(29-24)34-17-23(32)28-19-10-6-4-7-11-19/h1,5,8-9,12-16,19H,4,6-7,10-11,17H2,2H3,(H,28,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.74E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at mouse TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250416 (CHEMBL4063373) Show SMILES O=C(CSc1nc2cc[nH]c2c(=O)n1-c1ccccc1)NC1CCCCC1 Show InChI InChI=1S/C20H22N4O2S/c25-17(22-14-7-3-1-4-8-14)13-27-20-23-16-11-12-21-18(16)19(26)24(20)15-9-5-2-6-10-15/h2,5-6,9-12,14,21H,1,3-4,7-8,13H2,(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250417 (CHEMBL4101433) Show SMILES Cn1c2ccc(Br)cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C25H25BrN4O2S/c1-29-20-13-12-16(26)14-19(20)22-23(29)24(32)30(18-10-6-3-7-11-18)25(28-22)33-15-21(31)27-17-8-4-2-5-9-17/h3,6-7,10-14,17H,2,4-5,8-9,15H2,1H3,(H,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.58E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250418 (CHEMBL4073017) Show SMILES Cn1c2ccc(I)cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C25H25IN4O2S/c1-29-20-13-12-16(26)14-19(20)22-23(29)24(32)30(18-10-6-3-7-11-18)25(28-22)33-15-21(31)27-17-8-4-2-5-9-17/h3,6-7,10-14,17H,2,4-5,8-9,15H2,1H3,(H,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.75E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250419 (CHEMBL4064434) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)C#N Show InChI InChI=1S/C26H25N5O2S/c1-30-21-13-12-17(15-27)14-20(21)23-24(30)25(33)31(19-10-6-3-7-11-19)26(29-23)34-16-22(32)28-18-8-4-2-5-9-18/h3,6-7,10-14,18H,2,4-5,8-9,16H2,1H3,(H,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250420 (CHEMBL4085969) Show SMILES Cn1c2cc(ccc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)C#N Show InChI InChI=1S/C26H25N5O2S/c1-30-21-14-17(15-27)12-13-20(21)23-24(30)25(33)31(19-10-6-3-7-11-19)26(29-23)34-16-22(32)28-18-8-4-2-5-9-18/h3,6-7,10-14,18H,2,4-5,8-9,16H2,1H3,(H,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250421 (CHEMBL4097843) Show SMILES Cn1c2ccc(N)cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C25H27N5O2S/c1-29-20-13-12-16(26)14-19(20)22-23(29)24(32)30(18-10-6-3-7-11-18)25(28-22)33-15-21(31)27-17-8-4-2-5-9-17/h3,6-7,10-14,17H,2,4-5,8-9,15,26H2,1H3,(H,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250423 (CHEMBL4105577) Show SMILES CCCCCCCC(=O)Nc1ccc2n(C)c3c(nc(SCC(=O)NC4CCCCC4)n(-c4ccccc4)c3=O)c2c1 Show InChI InChI=1S/C33H41N5O3S/c1-3-4-5-6-13-18-28(39)35-24-19-20-27-26(21-24)30-31(37(27)2)32(41)38(25-16-11-8-12-17-25)33(36-30)42-22-29(40)34-23-14-9-7-10-15-23/h8,11-12,16-17,19-21,23H,3-7,9-10,13-15,18,22H2,1-2H3,(H,34,40)(H,35,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250424 (CHEMBL4087701) Show SMILES Cn1c2ccc(NC(=O)CCC(O)=O)cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C29H31N5O5S/c1-33-22-13-12-19(31-23(35)14-15-25(37)38)16-21(22)26-27(33)28(39)34(20-10-6-3-7-11-20)29(32-26)40-17-24(36)30-18-8-4-2-5-9-18/h3,6-7,10-13,16,18H,2,4-5,8-9,14-15,17H2,1H3,(H,30,36)(H,31,35)(H,37,38)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250433 (CHEMBL4095394) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C37H34N4O2S/c1-40-32-22-21-28(27-19-17-26(18-20-27)25-11-5-2-6-12-25)23-31(32)34-35(40)36(43)41(30-15-9-4-10-16-30)37(39-34)44-24-33(42)38-29-13-7-3-8-14-29/h2,4-6,9-12,15-23,29H,3,7-8,13-14,24H2,1H3,(H,38,42)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250413 (CHEMBL4078865) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)-c1cccc2ccccc12 Show InChI InChI=1S/C35H32N4O2S/c1-38-30-20-19-24(28-18-10-12-23-11-8-9-17-27(23)28)21-29(30)32-33(38)34(41)39(26-15-6-3-7-16-26)35(37-32)42-22-31(40)36-25-13-4-2-5-14-25/h3,6-12,15-21,25H,2,4-5,13-14,22H2,1H3,(H,36,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.12E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250434 (CHEMBL4103142) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)-c1ccc2ccccc2c1 Show InChI InChI=1S/C35H32N4O2S/c1-38-30-19-18-26(25-17-16-23-10-8-9-11-24(23)20-25)21-29(30)32-33(38)34(41)39(28-14-6-3-7-15-28)35(37-32)42-22-31(40)36-27-12-4-2-5-13-27/h3,6-11,14-21,27H,2,4-5,12-13,22H2,1H3,(H,36,40)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	920	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Homo sapiens (Human))	BDBM50250415 (CHEMBL4065290) Show SMILES Cn1c2ccc(cc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12)C#C Show InChI InChI=1S/C27H26N4O2S/c1-3-18-14-15-22-21(16-18)24-25(30(22)2)26(33)31(20-12-8-5-9-13-20)27(29-24)34-17-23(32)28-19-10-6-4-7-11-19/h1,5,8-9,12-16,19H,4,6-7,10-11,17H2,2H3,(H,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.27E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at human TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair
Toll-like receptor 4 (Mus musculus)	BDBM50250403 (CHEMBL2386454) Show SMILES Cn1c2ccccc2c2nc(SCC(=O)NC3CCCCC3)n(-c3ccccc3)c(=O)c12 Show InChI InChI=1S/C25H26N4O2S/c1-28-20-15-9-8-14-19(20)22-23(28)24(31)29(18-12-6-3-7-13-18)25(27-22)32-16-21(30)26-17-10-4-2-5-11-17/h3,6-9,12-15,17H,2,4-5,10-11,16H2,1H3,(H,26,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.17E+3	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Agonist activity at mouse TLR4 expressed in HEK293 blue cells assessed as induction of NF-kappaB activation-mediated SEAP production after 20 to 24 h...				J Med Chem 60: 9142-9161 (2017) Article DOI: 10.1021/acs.jmedchem.7b00797 BindingDB Entry DOI: 10.7270/Q2TQ63ZC
					More data for this Ligand-Target Pair

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