Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 6/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.51 |
| ▸ | PTGES | O14684 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CTRC | Q99895 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | PPARA | Q07869 | 3/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13444679 | 0.96 | TSHR (0.51) | PPARGALOX5PTGESTSHRTP53 | |
| SCHEMBL28003097 | 0.94 | PPARG (0.51) | PPARGALOX5PTGESTSHRTP53 | |
| SCHEMBL28508756 | 0.90 | CTRC (0.50) | PPARGALOX5PTGESTSHRTP53 | |
| SCHEMBL15902941 | 0.90 | CTRC (0.50) | PPARGALOX5PTGESTSHRTP53 | |
| SCHEMBL27637374 | 0.88 | TSHR (0.53) | PPARGTSHRTP53CYP3A4MAPK1 | |
| SCHEMBL5210592 | 0.88 | TDP1 (0.54) | PPARGALOX5PTGESCYP3A4LMNA | |
| SCHEMBL8722173 | 0.86 | PPARG (0.51) | PPARGALOX5PTGESTSHRCYP3A4 | |
| SCHEMBL11858517 | 0.85 | PPARG (0.50) | PPARGALOX5PTGESTSHRLMNA | |
| SCHEMBL16673232 | 0.85 | TSHR (0.50) | PPARGTSHRTP53CYP3A4MAPK1 | |
| SCHEMBL11617518 | 0.84 | CTRC (0.52) | PPARGALOX5PTGESTSHRLMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6670367-B1 | Vasodilator; hypertension; surprisingly show antagonistic action on the neurokinin receptor; 2-(4-Methoxy-6-methyl-2-pyrimidinyloxy)-3-(2-(3,4- dimethoxyphenyl)ethoxy)-3,3-diphenylpropionic Acid | ABBOTT GMBH & CO., KG (DE) | 2003-12-30 | — | — | US | disclosed |