Found 16 hits Enz. Inhib. hit(s) with all data for entry = 50046852 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 delta
(Homo sapiens (Human)) | BDBM50415440
(CHEMBL598608 | GSK-3787)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClF3N2O3S/c16-12-4-1-10(2-5-12)14(22)20-7-8-25(23,24)13-6-3-11(9-21-13)15(17,18)19/h1-6,9H,7-8H2,(H,20,22) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 24 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50383371
(CHEMBL2030550)Show InChI InChI=1S/C20H20BrN3/c1-23-10-12-24(13-11-23)18-8-6-16(7-9-18)14-17(15-22)19-4-2-3-5-20(19)21/h2-9,14H,10-13H2,1H3/b17-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 40 mins by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50383371
(CHEMBL2030550)Show InChI InChI=1S/C20H20BrN3/c1-23-10-12-24(13-11-23)18-8-6-16(7-9-18)14-17(15-22)19-4-2-3-5-20(19)21/h2-9,14H,10-13H2,1H3/b17-14+ | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 40 mins by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50134238
(CHEMBL3740002)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1cnc2ccccc2c1 Show InChI InChI=1S/C18H14F3N3O3S/c19-18(20,21)14-5-6-16(24-11-14)28(26,27)8-7-22-17(25)13-9-12-3-1-2-4-15(12)23-10-13/h1-6,9-11H,7-8H2,(H,22,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 241 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 24 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50415440
(CHEMBL598608 | GSK-3787)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClF3N2O3S/c16-12-4-1-10(2-5-12)14(22)20-7-8-25(23,24)13-6-3-11(9-21-13)15(17,18)19/h1-6,9H,7-8H2,(H,20,22) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 284 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 2 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50079260
(CHEMBL3416764)Show SMILES Cc1nc(sc1C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C20H15F6N3O3S2/c1-11-16(33-18(29-11)12-2-4-13(5-3-12)19(21,22)23)17(30)27-8-9-34(31,32)15-7-6-14(10-28-15)20(24,25)26/h2-7,10H,8-9H2,1H3,(H,27,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 284 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 3 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50079260
(CHEMBL3416764)Show SMILES Cc1nc(sc1C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C20H15F6N3O3S2/c1-11-16(33-18(29-11)12-2-4-13(5-3-12)19(21,22)23)17(30)27-8-9-34(31,32)15-7-6-14(10-28-15)20(24,25)26/h2-7,10H,8-9H2,1H3,(H,27,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 301 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 2 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50079260
(CHEMBL3416764)Show SMILES Cc1nc(sc1C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C20H15F6N3O3S2/c1-11-16(33-18(29-11)12-2-4-13(5-3-12)19(21,22)23)17(30)27-8-9-34(31,32)15-7-6-14(10-28-15)20(24,25)26/h2-7,10H,8-9H2,1H3,(H,27,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 423 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 1 hr by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50134237
(CHEMBL3740369)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc2CCCCc2c1 Show InChI InChI=1S/C19H19F3N2O3S/c20-19(21,22)16-7-8-17(24-12-16)28(26,27)10-9-23-18(25)15-6-5-13-3-1-2-4-14(13)11-15/h5-8,11-12H,1-4,9-10H2,(H,23,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 598 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 3 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50415440
(CHEMBL598608 | GSK-3787)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClF3N2O3S/c16-12-4-1-10(2-5-12)14(22)20-7-8-25(23,24)13-6-3-11(9-21-13)15(17,18)19/h1-6,9H,7-8H2,(H,20,22) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 648 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 1 hr by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50134237
(CHEMBL3740369)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc2CCCCc2c1 Show InChI InChI=1S/C19H19F3N2O3S/c20-19(21,22)16-7-8-17(24-12-16)28(26,27)10-9-23-18(25)15-6-5-13-3-1-2-4-14(13)11-15/h5-8,11-12H,1-4,9-10H2,(H,23,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 907 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 2 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50079260
(CHEMBL3416764)Show SMILES Cc1nc(sc1C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C20H15F6N3O3S2/c1-11-16(33-18(29-11)12-2-4-13(5-3-12)19(21,22)23)17(30)27-8-9-34(31,32)15-7-6-14(10-28-15)20(24,25)26/h2-7,10H,8-9H2,1H3,(H,27,30) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 949 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 20 mins by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50415440
(CHEMBL598608 | GSK-3787)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClF3N2O3S/c16-12-4-1-10(2-5-12)14(22)20-7-8-25(23,24)13-6-3-11(9-21-13)15(17,18)19/h1-6,9H,7-8H2,(H,20,22) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.32E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 20 mins by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50134238
(CHEMBL3740002)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1cnc2ccccc2c1 Show InChI InChI=1S/C18H14F3N3O3S/c19-18(20,21)14-5-6-16(24-11-14)28(26,27)8-7-22-17(25)13-9-12-3-1-2-4-15(12)23-10-13/h1-6,9-11H,7-8H2,(H,22,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| n/a | n/a | 1.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 3 hrs by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50134239
(CHEMBL3740264)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C19H15F3N2O3S/c20-19(21,22)16-7-8-17(24-12-16)28(26,27)10-9-23-18(25)15-6-5-13-3-1-2-4-14(13)11-15/h1-8,11-12H,9-10H2,(H,23,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.93E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 20 mins by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50134237
(CHEMBL3740369)Show SMILES FC(F)(F)c1ccc(nc1)S(=O)(=O)CCNC(=O)c1ccc2CCCCc2c1 Show InChI InChI=1S/C19H19F3N2O3S/c20-19(21,22)16-7-8-17(24-12-16)28(26,27)10-9-23-18(25)15-6-5-13-3-1-2-4-14(13)11-15/h5-8,11-12H,1-4,9-10H2,(H,23,25) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Oslo
Curated by ChEMBL
| Assay Description
Binding affinity to GST-PPAR-beta/delta LBP (unknown origin) after 20 mins by TR-FRET assay |
Bioorg Med Chem 24: 247-60 (2016)
Article DOI: 10.1016/j.bmc.2015.12.012
BindingDB Entry DOI: 10.7270/Q2Z89F70 |
More data for this
Ligand-Target Pair | |
Search and Browse
