Found 6 hits Enz. Inhib. hit(s) with all data for assayid = 2 entry = 50002749 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 |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50462438
![PNG](/data/jpeg/tenK5046/BindingDB_50462438.png) (CHEMBL4237642)Show SMILES COc1ccc(COc2ccc(CNc3cccc(OC(C)(C)C(O)=O)c3)c(OCc3ccc(OC)cc3)c2)cc1 Show InChI InChI=1S/C33H35NO7/c1-33(2,32(35)36)41-30-7-5-6-26(18-30)34-20-25-12-17-29(39-21-23-8-13-27(37-3)14-9-23)19-31(25)40-22-24-10-15-28(38-4)16-11-24/h5-19,34H,20-22H2,1-4H3,(H,35,36) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a |
University of Oklahoma
Curated by ChEMBL
| Assay Description Agonist activity at human PPARalpha after 22 to 24 hrs by luciferase reporter gene assay |
Bioorg Med Chem Lett 28: 2717-2722 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.010 BindingDB Entry DOI: 10.7270/Q24F1TCK |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50462437
![PNG](/data/jpeg/tenK5046/BindingDB_50462437.png) (CHEMBL4240338)Show SMILES COc1ccc(COc2ccc(CNc3cccc(c3)C(O)=O)c(OCc3ccc(OC)cc3)c2)cc1 Show InChI InChI=1S/C30H29NO6/c1-34-26-11-6-21(7-12-26)19-36-28-15-10-24(18-31-25-5-3-4-23(16-25)30(32)33)29(17-28)37-20-22-8-13-27(35-2)14-9-22/h3-17,31H,18-20H2,1-2H3,(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 5.10E+3 | n/a | n/a | n/a | n/a |
University of Oklahoma
Curated by ChEMBL
| Assay Description Agonist activity at human PPARalpha after 22 to 24 hrs by luciferase reporter gene assay |
Bioorg Med Chem Lett 28: 2717-2722 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.010 BindingDB Entry DOI: 10.7270/Q24F1TCK |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM28706
![PNG](/data/jpeg/tenK2/BindingDB_28706.png) (2-methyl-2-phenoxypropanoic acid, 25a | 2-methyl-2...)Show SMILES Cc1nc(sc1C(=O)NCc1ccc(OC(C)(C)C(O)=O)cc1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C23H21F3N2O4S/c1-13-18(33-20(28-13)15-6-8-16(9-7-15)23(24,25)26)19(29)27-12-14-4-10-17(11-5-14)32-22(2,3)21(30)31/h4-11H,12H2,1-3H3,(H,27,29)(H,30,31) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | n/a | n/a | 12 | n/a | n/a | n/a | n/a |
University of Oklahoma
Curated by ChEMBL
| Assay Description Agonist activity at human PPARalpha after 22 to 24 hrs by luciferase reporter gene assay |
Bioorg Med Chem Lett 28: 2717-2722 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.010 BindingDB Entry DOI: 10.7270/Q24F1TCK |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50462441
![PNG](/data/jpeg/tenK5046/BindingDB_50462441.png) (CHEMBL1565327)Show InChI InChI=1S/C17H12ClNO2/c1-10-14(18)8-7-12-13(17(20)21)9-15(19-16(10)12)11-5-3-2-4-6-11/h2-9H,1H3,(H,20,21) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
MCE PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 5.24E+4 | n/a | n/a | n/a | n/a |
University of Oklahoma
Curated by ChEMBL
| Assay Description Agonist activity at human PPARalpha after 22 to 24 hrs by luciferase reporter gene assay |
Bioorg Med Chem Lett 28: 2717-2722 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.010 BindingDB Entry DOI: 10.7270/Q24F1TCK |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50462440
![PNG](/data/jpeg/tenK5046/BindingDB_50462440.png) (CHEMBL4240680)Show SMILES COc1ccc(COc2ccc(CNc3cccc(OC(C)(C)C(O)=O)c3)cc2)cc1 Show InChI InChI=1S/C25H27NO5/c1-25(2,24(27)28)31-23-6-4-5-20(15-23)26-16-18-7-13-22(14-8-18)30-17-19-9-11-21(29-3)12-10-19/h4-15,26H,16-17H2,1-3H3,(H,27,28) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 2.53E+4 | n/a | n/a | n/a | n/a |
University of Oklahoma
Curated by ChEMBL
| Assay Description Agonist activity at human PPARalpha after 22 to 24 hrs by luciferase reporter gene assay |
Bioorg Med Chem Lett 28: 2717-2722 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.010 BindingDB Entry DOI: 10.7270/Q24F1TCK |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha
(Homo sapiens (Human)) | BDBM50462439
![PNG](/data/jpeg/tenK5046/BindingDB_50462439.png) (CHEMBL4237449)Show InChI InChI=1S/C22H21NO4/c1-26-20-9-7-17(8-10-20)15-27-21-11-5-16(6-12-21)14-23-19-4-2-3-18(13-19)22(24)25/h2-13,23H,14-15H2,1H3,(H,24,25) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 5.60E+3 | n/a | n/a | n/a | n/a |
University of Oklahoma
Curated by ChEMBL
| Assay Description Agonist activity at human PPARalpha after 22 to 24 hrs by luciferase reporter gene assay |
Bioorg Med Chem Lett 28: 2717-2722 (2018)
Article DOI: 10.1016/j.bmcl.2018.03.010 BindingDB Entry DOI: 10.7270/Q24F1TCK |
More data for this Ligand-Target Pair | |