Found 4 hits for monomerid = 50362956 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Peroxisome proliferator-activated receptor
(Homo sapiens (Human)) | BDBM50362956
(CHEMBL1946756)Show SMILES COc1ccc2c(noc2c1)-n1c2ccc(OC(F)(F)F)cc2n(Cc2ccc(Cl)c(O[C@H](C)C(O)=O)c2)c1=O |r,wU:32.35,(27.18,-40.65,;25.85,-39.88,;24.51,-40.64,;24.51,-42.19,;23.16,-42.96,;21.83,-42.18,;20.37,-42.63,;19.47,-41.39,;20.38,-40.15,;21.85,-40.63,;23.18,-39.87,;19.61,-43.97,;18.15,-44.45,;16.81,-43.69,;15.48,-44.46,;15.48,-46,;14.15,-46.77,;12.81,-46,;11.48,-46.77,;12.81,-44.46,;11.47,-45.23,;16.82,-46.77,;18.16,-45.99,;19.63,-46.46,;19.65,-48,;21,-48.75,;21.01,-50.29,;22.36,-51.03,;23.68,-50.24,;25.03,-50.99,;23.65,-48.69,;24.97,-47.9,;26.32,-48.64,;26.35,-50.18,;27.63,-47.84,;28.98,-48.59,;27.6,-46.3,;22.3,-47.95,;20.53,-45.21,;22.07,-45.2,)| Show InChI InChI=1S/C26H19ClF3N3O7/c1-13(24(34)35)38-22-9-14(3-7-18(22)27)12-32-20-10-16(39-26(28,29)30)5-8-19(20)33(25(32)36)23-17-6-4-15(37-2)11-21(17)40-31-23/h3-11,13H,12H2,1-2H3,(H,34,35)/t13-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Binding affinity to human PPARgamma by scintillation proximity assay |
J Med Chem 54: 8541-54 (2011)
Article DOI: 10.1021/jm201061j
BindingDB Entry DOI: 10.7270/Q2542P11 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor delta
(Homo sapiens (Human)) | BDBM50362956
(CHEMBL1946756)Show SMILES COc1ccc2c(noc2c1)-n1c2ccc(OC(F)(F)F)cc2n(Cc2ccc(Cl)c(O[C@H](C)C(O)=O)c2)c1=O |r,wU:32.35,(27.18,-40.65,;25.85,-39.88,;24.51,-40.64,;24.51,-42.19,;23.16,-42.96,;21.83,-42.18,;20.37,-42.63,;19.47,-41.39,;20.38,-40.15,;21.85,-40.63,;23.18,-39.87,;19.61,-43.97,;18.15,-44.45,;16.81,-43.69,;15.48,-44.46,;15.48,-46,;14.15,-46.77,;12.81,-46,;11.48,-46.77,;12.81,-44.46,;11.47,-45.23,;16.82,-46.77,;18.16,-45.99,;19.63,-46.46,;19.65,-48,;21,-48.75,;21.01,-50.29,;22.36,-51.03,;23.68,-50.24,;25.03,-50.99,;23.65,-48.69,;24.97,-47.9,;26.32,-48.64,;26.35,-50.18,;27.63,-47.84,;28.98,-48.59,;27.6,-46.3,;22.3,-47.95,;20.53,-45.21,;22.07,-45.2,)| Show InChI InChI=1S/C26H19ClF3N3O7/c1-13(24(34)35)38-22-9-14(3-7-18(22)27)12-32-20-10-16(39-26(28,29)30)5-8-19(20)33(25(32)36)23-17-6-4-15(37-2)11-21(17)40-31-23/h3-11,13H,12H2,1-2H3,(H,34,35)/t13-/m1/s1 | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Binding affinity to PPARdelta by scintillation proximity assay |
J Med Chem 54: 8541-54 (2011)
Article DOI: 10.1021/jm201061j
BindingDB Entry DOI: 10.7270/Q2542P11 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor alpha (PPAR alpha)
(Homo sapiens (Human)) | BDBM50362956
(CHEMBL1946756)Show SMILES COc1ccc2c(noc2c1)-n1c2ccc(OC(F)(F)F)cc2n(Cc2ccc(Cl)c(O[C@H](C)C(O)=O)c2)c1=O |r,wU:32.35,(27.18,-40.65,;25.85,-39.88,;24.51,-40.64,;24.51,-42.19,;23.16,-42.96,;21.83,-42.18,;20.37,-42.63,;19.47,-41.39,;20.38,-40.15,;21.85,-40.63,;23.18,-39.87,;19.61,-43.97,;18.15,-44.45,;16.81,-43.69,;15.48,-44.46,;15.48,-46,;14.15,-46.77,;12.81,-46,;11.48,-46.77,;12.81,-44.46,;11.47,-45.23,;16.82,-46.77,;18.16,-45.99,;19.63,-46.46,;19.65,-48,;21,-48.75,;21.01,-50.29,;22.36,-51.03,;23.68,-50.24,;25.03,-50.99,;23.65,-48.69,;24.97,-47.9,;26.32,-48.64,;26.35,-50.18,;27.63,-47.84,;28.98,-48.59,;27.6,-46.3,;22.3,-47.95,;20.53,-45.21,;22.07,-45.2,)| Show InChI InChI=1S/C26H19ClF3N3O7/c1-13(24(34)35)38-22-9-14(3-7-18(22)27)12-32-20-10-16(39-26(28,29)30)5-8-19(20)33(25(32)36)23-17-6-4-15(37-2)11-21(17)40-31-23/h3-11,13H,12H2,1-2H3,(H,34,35)/t13-/m1/s1 | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Binding affinity to human PPARalpha expressed in COS-1 by scintillation proximity assay |
J Med Chem 54: 8541-54 (2011)
Article DOI: 10.1021/jm201061j
BindingDB Entry DOI: 10.7270/Q2542P11 |
More data for this
Ligand-Target Pair | |
Peroxisome proliferator-activated receptor
(Homo sapiens (Human)) | BDBM50362956
(CHEMBL1946756)Show SMILES COc1ccc2c(noc2c1)-n1c2ccc(OC(F)(F)F)cc2n(Cc2ccc(Cl)c(O[C@H](C)C(O)=O)c2)c1=O |r,wU:32.35,(27.18,-40.65,;25.85,-39.88,;24.51,-40.64,;24.51,-42.19,;23.16,-42.96,;21.83,-42.18,;20.37,-42.63,;19.47,-41.39,;20.38,-40.15,;21.85,-40.63,;23.18,-39.87,;19.61,-43.97,;18.15,-44.45,;16.81,-43.69,;15.48,-44.46,;15.48,-46,;14.15,-46.77,;12.81,-46,;11.48,-46.77,;12.81,-44.46,;11.47,-45.23,;16.82,-46.77,;18.16,-45.99,;19.63,-46.46,;19.65,-48,;21,-48.75,;21.01,-50.29,;22.36,-51.03,;23.68,-50.24,;25.03,-50.99,;23.65,-48.69,;24.97,-47.9,;26.32,-48.64,;26.35,-50.18,;27.63,-47.84,;28.98,-48.59,;27.6,-46.3,;22.3,-47.95,;20.53,-45.21,;22.07,-45.2,)| Show InChI InChI=1S/C26H19ClF3N3O7/c1-13(24(34)35)38-22-9-14(3-7-18(22)27)12-32-20-10-16(39-26(28,29)30)5-8-19(20)33(25(32)36)23-17-6-4-15(37-2)11-21(17)40-31-23/h3-11,13H,12H2,1-2H3,(H,34,35)/t13-/m1/s1 | PDB
MMDB
NCI pathway
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 | n/a | 11.4 | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Agonist activity at human PPARgamma expressed in COS-1 cells co-expressing with Gal4 by transactivation assay |
J Med Chem 54: 8541-54 (2011)
Article DOI: 10.1021/jm201061j
BindingDB Entry DOI: 10.7270/Q2542P11 |
More data for this
Ligand-Target Pair | |
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