3697 : 2-{2-methyl-4-[(1-{4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}-2,2-diphenylethyl)sulfanyl]phenoxy}acetic acid
Ligand Basic Message
| Ligand | Scaffold |
|---|---|
 |  |
| ID | 3697 |
| Name | 2-{2-methyl-4-[(1-{4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}-2,2-diphenylethyl)sulfanyl]phenoxy}acetic acid |
| smile | CC1=CC(=CC=C1OCC(O)=O)SC(C1SC(C2=CC=C(C(F)(F)F)C=C2)=NC=1C)C(C1=CC=CC=C1)C1=CC=CC=C1 |
| weight | 620 |
| scaffold ID | 401 |
| scaffold smile | c1nc(-c2ccccc2)sc1C(Sc1ccccc1)C(c1ccccc1)c1ccccc1 |
Ligand Activities
| NR Protein | Protein Name | Ligand ID | Ligand Name | EC 50 |
|---|---|---|---|---|
| NR1C1 | Peroxisome proliferator activated receptor alpha | 3697 | 2-{2-methyl-4-[(1-{4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}-2,2-diphenylethyl)sulfanyl]phenoxy}acetic acid | 10.0 |
Scaffold Activities Statistic