Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 7/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | FABP2 | P12104 | 2/20 | 0.54 |
| ▸ | PPARG | P37231 | 2/20 | 0.54 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.54 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11712579 | 0.94 | PPARA (0.55) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL4755781 | 0.93 | PPARA (0.66) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL11716530 | 0.88 | MAPT (0.59) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL11714161 | 0.86 | ALDH1A1 (0.44) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL11716391 | 0.84 | PPARA (0.65) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL1584133 | 0.84 | PPARA (0.59) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL13983837 | 0.83 | PPARA (0.52) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL21413784 | 0.82 | PPARA (0.62) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL11714411 | 0.81 | ALDH1A1 (0.41) | PPARACYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL3525024 | 0.81 | PPARA (0.56) | PPARACYP1A2CYP3A4CYP2C19MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4033974-A | Pyridylmethyl esters of N-(phenoxyalkanoyl)peptide derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1977-07-05 | — | — | US | disclosed |
| US-3956484-A | Pyridylmethyl esters of N-(phenoxyalkanoyl)peptide derivatives for therepeutic use | AMERICAN HOME PRODUCTS CORPORATION (US) | 1976-05-11 | — | — | US | disclosed |