Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 7/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | HTR2A | P28223 | 1/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | PPARG | P37231 | 3/20 | 0.49 |
| ▸ | CNR2 | P34972 | 2/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.41 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.41 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.41 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.41 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.41 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8768076 | 1.00 | PPARA (0.59) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8768812 | 0.86 | PPARA (0.56) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8768869 | 0.86 | PPARA (0.56) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8768912 | 0.84 | PPARA (0.49) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8768649 | 0.81 | PPARA (0.48) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8768902 | 0.81 | PPARA (0.48) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8768838 | 0.79 | PPARA (0.48) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8767713 | 0.78 | PPARA (0.51) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8767756 | 0.77 | PPARA (0.46) | PPARACYP1A2CYP3A4ABCB11TSHR | |
| SCHEMBL8767949 | 0.77 | PPARA (0.46) | PPARACYP1A2CYP3A4ABCB11TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0639178-B1 | ANTI-ATHEROSCLEROTIC ARYL COMPOUNDS | WELLCOME FOUND (GB) | 1997-09-03 | — | — | EP | disclosed |
| US-5658944-A | ANTICHOLESTEROL AGENTS | THE UNIVERSITY OF SOUTH CAROLINA (US) | 1997-08-19 | — | — | US | disclosed |