Found 34 hits with Last Name = 'dittrich-wengenroth' and Initial = 'e' 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 |
Prothrombin
(Homo sapiens (Human)) | BDBM98168
(US8487111, 8)Show SMILES COCc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O6S/c1-33-14-16-11-17(4-5-19(16)27-9-2-3-15(8-10-29)23(27)31)28-13-18(34-24(28)32)12-26-22(30)20-6-7-21(25)35-20/h2-7,9,11,18,29H,8,10,12-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98166
(US8487111, 2)Show SMILES Cc1cc(ccc1-n1cccc(CO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C22H20ClN3O5S/c1-13-9-15(4-5-17(13)25-8-2-3-14(12-27)21(25)29)26-11-16(31-22(26)30)10-24-20(28)18-6-7-19(23)32-18/h2-9,16,27H,10-12H2,1H3,(H,24,28)/t16-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98169
(US8487111, 10)Show SMILES Cc1cc(ccc1-n1cccc(CCCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O5S/c1-15-12-17(6-7-19(15)27-10-2-4-16(23(27)31)5-3-11-29)28-14-18(33-24(28)32)13-26-22(30)20-8-9-21(25)34-20/h2,4,6-10,12,18,29H,3,5,11,13-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98167
(US8487111, 6)Show SMILES Cc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C23H22ClN3O5S/c1-14-11-16(4-5-18(14)26-9-2-3-15(8-10-28)22(26)30)27-13-17(32-23(27)31)12-25-21(29)19-6-7-20(24)33-19/h2-7,9,11,17,28H,8,10,12-13H2,1H3,(H,25,29)/t17-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM98169
(US8487111, 10)Show SMILES Cc1cc(ccc1-n1cccc(CCCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O5S/c1-15-12-17(6-7-19(15)27-10-2-4-16(23(27)31)5-3-11-29)28-14-18(33-24(28)32)13-26-22(30)20-8-9-21(25)34-20/h2,4,6-10,12,18,29H,3,5,11,13-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 74 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Coagulation factor X
(Homo sapiens (Human)) | BDBM98168
(US8487111, 8)Show SMILES COCc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C24H24ClN3O6S/c1-33-14-16-11-17(4-5-19(16)27-9-2-3-15(8-10-29)23(27)31)28-13-18(34-24(28)32)12-26-22(30)20-6-7-21(25)35-20/h2-7,9,11,18,29H,8,10,12-14H2,1H3,(H,26,30)/t18-/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 167 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Factor Xa inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM98167
(US8487111, 6)Show SMILES Cc1cc(ccc1-n1cccc(CCO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C23H22ClN3O5S/c1-14-11-16(4-5-18(14)26-9-2-3-15(8-10-28)22(26)30)27-13-17(32-23(27)31)12-25-21(29)19-6-7-20(24)33-19/h2-7,9,11,17,28H,8,10,12-13H2,1H3,(H,25,29)/t17-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 186 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Prothrombin
(Homo sapiens (Human)) | BDBM98166
(US8487111, 2)Show SMILES Cc1cc(ccc1-n1cccc(CO)c1=O)N1C[C@H](CNC(=O)c2ccc(Cl)s2)OC1=O |r| Show InChI InChI=1S/C22H20ClN3O5S/c1-13-9-15(4-5-17(13)25-8-2-3-14(12-27)21(25)29)26-11-16(31-22(26)30)10-24-20(28)18-6-7-19(23)32-18/h2-9,16,27H,10-12H2,1H3,(H,24,28)/t16-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| n/a | n/a | 198 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Intellectual Property GmbH
US Patent
| Assay Description Thrombin inhibitory activity. |
US Patent US8487111 (2013)
BindingDB Entry DOI: 10.7270/Q29K48V9 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM28799
(2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...)Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARdelta |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319264
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(th...)Show SMILES Cc1ccc(NC(=O)CN(Cc2cccs2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C26H30N2O4S/c1-18-7-12-23(19(2)14-18)27-24(29)17-28(16-22-6-5-13-33-22)15-20-8-10-21(11-9-20)32-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 700 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319265
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(4-...)Show SMILES COc1ccc(CN(CC(=O)Nc2ccc(C)cc2C)Cc2ccc(OC(C)(C)C(O)=O)cc2)cc1 Show InChI InChI=1S/C29H34N2O5/c1-20-6-15-26(21(2)16-20)30-27(32)19-31(17-22-7-11-24(35-5)12-8-22)18-23-9-13-25(14-10-23)36-29(3,4)28(33)34/h6-16H,17-19H2,1-5H3,(H,30,32)(H,33,34) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 900 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319266
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(pr...)Show SMILES CCCN(CC(=O)Nc1ccc(C)cc1C)Cc1ccc(OC(C)(C)C(O)=O)cc1 Show InChI InChI=1S/C24H32N2O4/c1-6-13-26(16-22(27)25-21-12-7-17(2)14-18(21)3)15-19-8-10-20(11-9-19)30-24(4,5)23(28)29/h7-12,14H,6,13,15-16H2,1-5H3,(H,25,27)(H,28,29) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319267
(2-(4-((butyl(2-(2,4-dimethylphenylamino)-2-oxoethy...)Show SMILES CCCCN(CC(=O)Nc1ccc(C)cc1C)Cc1ccc(OC(C)(C)C(O)=O)cc1 Show InChI InChI=1S/C25H34N2O4/c1-6-7-14-27(17-23(28)26-22-13-8-18(2)15-19(22)3)16-20-9-11-21(12-10-20)31-25(4,5)24(29)30/h8-13,15H,6-7,14,16-17H2,1-5H3,(H,26,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL 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 |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319268
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(he...)Show SMILES CCCCCCCN(CC(=O)Nc1ccc(C)cc1C)Cc1ccc(OC(C)(C)C(O)=O)cc1 Show InChI InChI=1S/C28H40N2O4/c1-6-7-8-9-10-17-30(20-26(31)29-25-16-11-21(2)18-22(25)3)19-23-12-14-24(15-13-23)34-28(4,5)27(32)33/h11-16,18H,6-10,17,19-20H2,1-5H3,(H,29,31)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319269
(2-(4-(((furan-2-ylmethyl)(2-oxo-2-(o-tolylamino)et...)Show SMILES Cc1ccccc1NC(=O)CN(Cc1ccco1)Cc1ccc(OC(C)(C)C(O)=O)cc1 Show InChI InChI=1S/C25H28N2O5/c1-18-7-4-5-9-22(18)26-23(28)17-27(16-21-8-6-14-31-21)15-19-10-12-20(13-11-19)32-25(2,3)24(29)30/h4-14H,15-17H2,1-3H3,(H,26,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319270
(2-(4-(((2-(2,5-dimethylphenylamino)-2-oxoethyl)(fu...)Show SMILES Cc1ccc(C)c(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c1 Show InChI InChI=1S/C26H30N2O5/c1-18-7-8-19(2)23(14-18)27-24(29)17-28(16-22-6-5-13-32-22)15-20-9-11-21(12-10-20)33-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 600 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319271
(2-(4-(((2-(2,5-dimethoxyphenylamino)-2-oxoethyl)(f...)Show SMILES COc1ccc(OC)c(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c1 Show InChI InChI=1S/C26H30N2O7/c1-26(2,25(30)31)35-19-9-7-18(8-10-19)15-28(16-21-6-5-13-34-21)17-24(29)27-22-14-20(32-3)11-12-23(22)33-4/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 300 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319272
(2-(4-(((furan-2-ylmethyl)(2-(3-methoxyphenylamino)...)Show SMILES COc1cccc(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c1 Show InChI InChI=1S/C25H28N2O6/c1-25(2,24(29)30)33-20-11-9-18(10-12-20)15-27(16-22-8-5-13-32-22)17-23(28)26-19-6-4-7-21(14-19)31-3/h4-14H,15-17H2,1-3H3,(H,26,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319273
(2-(4-(((2-(2,4-difluorophenylamino)-2-oxoethyl)(fu...)Show SMILES CC(C)(Oc1ccc(CN(CC(=O)Nc2ccc(F)cc2F)Cc2ccco2)cc1)C(O)=O Show InChI InChI=1S/C24H24F2N2O5/c1-24(2,23(30)31)33-18-8-5-16(6-9-18)13-28(14-19-4-3-11-32-19)15-22(29)27-21-10-7-17(25)12-20(21)26/h3-12H,13-15H2,1-2H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319274
(2-(4-(((furan-2-ylmethyl)(2-oxo-2-(pyridin-2-ylami...)Show SMILES CC(C)(Oc1ccc(CN(CC(=O)Nc2ccccn2)Cc2ccco2)cc1)C(O)=O Show InChI InChI=1S/C23H25N3O5/c1-23(2,22(28)29)31-18-10-8-17(9-11-18)14-26(15-19-6-5-13-30-19)16-21(27)25-20-7-3-4-12-24-20/h3-13H,14-16H2,1-2H3,(H,28,29)(H,24,25,27) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319275
(2-(4-(((2-(benzylamino)-2-oxoethyl)(furan-2-ylmeth...)Show SMILES CC(C)(Oc1ccc(CN(CC(=O)NCc2ccccc2)Cc2ccco2)cc1)C(O)=O Show InChI InChI=1S/C25H28N2O5/c1-25(2,24(29)30)32-21-12-10-20(11-13-21)16-27(17-22-9-6-14-31-22)18-23(28)26-15-19-7-4-3-5-8-19/h3-14H,15-18H2,1-2H3,(H,26,28)(H,29,30) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 1.30E+4 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319276
(2-(4-(((2-(2-chlorobenzylamino)-2-oxoethyl)(furan-...)Show SMILES CC(C)(Oc1ccc(CN(CC(=O)NCc2ccccc2Cl)Cc2ccco2)cc1)C(O)=O Show InChI InChI=1S/C25H27ClN2O5/c1-25(2,24(30)31)33-20-11-9-18(10-12-20)15-28(16-21-7-5-13-32-21)17-23(29)27-14-19-6-3-4-8-22(19)26/h3-13H,14-17H2,1-2H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM28799
(2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...)Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 100 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM28799
(2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...)Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARgamma |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50319262
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(fu...)Show SMILES Cc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C26H30N2O5/c1-18-7-12-23(19(2)14-18)27-24(29)17-28(16-22-6-5-13-32-22)15-20-8-10-21(11-9-20)33-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB MMDB
NCI pathway 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 | n/a | 800 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARgamma |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319262
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(fu...)Show SMILES Cc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C26H30N2O5/c1-18-7-12-23(19(2)14-18)27-24(29)17-28(16-22-6-5-13-32-22)15-20-8-10-21(11-9-20)33-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 20 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Mus musculus) | BDBM50319262
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(fu...)Show SMILES Cc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C26H30N2O5/c1-18-7-12-23(19(2)14-18)27-24(29)17-28(16-22-6-5-13-32-22)15-20-8-10-21(11-9-20)33-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused mouse PPARdelta |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Mus musculus) | BDBM28799
(2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...)Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused mouse PPARdelta |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Mus musculus) | BDBM50319262
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(fu...)Show SMILES Cc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C26H30N2O5/c1-18-7-12-23(19(2)14-18)27-24(29)17-28(16-22-6-5-13-32-22)15-20-8-10-21(11-9-20)33-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 300 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused mouse PPARgamma |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Mus musculus) | BDBM28799
(2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...)Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused mouse PPARgamma |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Mus musculus) | BDBM50319262
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(fu...)Show SMILES Cc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C26H30N2O5/c1-18-7-12-23(19(2)14-18)27-24(29)17-28(16-22-6-5-13-32-22)15-20-8-10-21(11-9-20)33-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 20 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused mouse PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Mus musculus) | BDBM28799
(2-{[4-(2-{[(2,4-difluorophenyl)carbamoyl](heptyl)a...)Show SMILES CCCCCCCN(CCc1ccc(SC(C)(C)C(O)=O)cc1)C(=O)Nc1ccc(F)cc1F Show InChI InChI=1S/C26H34F2N2O3S/c1-4-5-6-7-8-16-30(25(33)29-23-14-11-20(27)18-22(23)28)17-15-19-9-12-21(13-10-19)34-26(2,3)24(31)32/h9-14,18H,4-8,15-17H2,1-3H3,(H,29,33)(H,31,32) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 10 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused mouse PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50319262
(2-(4-(((2-(2,4-dimethylphenylamino)-2-oxoethyl)(fu...)Show SMILES Cc1ccc(NC(=O)CN(Cc2ccco2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C26H30N2O5/c1-18-7-12-23(19(2)14-18)27-24(29)17-28(16-22-6-5-13-32-22)15-20-8-10-21(11-9-20)33-26(3,4)25(30)31/h5-14H,15-17H2,1-4H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARdelta |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50319263
(2-(4-((benzyl(2-(2,4-dimethylphenylamino)-2-oxoeth...)Show SMILES Cc1ccc(NC(=O)CN(Cc2ccccc2)Cc2ccc(OC(C)(C)C(O)=O)cc2)c(C)c1 Show InChI InChI=1S/C28H32N2O4/c1-20-10-15-25(21(2)16-20)29-26(31)19-30(17-22-8-6-5-7-9-22)18-23-11-13-24(14-12-23)34-28(3,4)27(32)33/h5-16H,17-19H2,1-4H3,(H,29,31)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a |
Bayer-Schering Pharma
Curated by ChEMBL
| Assay Description Agonist activity at Gal4-fused human PPARalpha |
Bioorg Med Chem Lett 20: 3376-9 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.019 BindingDB Entry DOI: 10.7270/Q27944V8 |
More data for this Ligand-Target Pair | |