Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 10/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | ACP1 | P24666 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | VCP | P55072 | 1/20 | 0.42 |
| ▸ | ATR | Q13535 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8304819 | 0.79 | CCR1 (0.50) | CYP3A4CYP1A2CYP2C19CYP2D6ALOX15 | |
| SCHEMBL26739772 | 0.79 | DHODH (0.51) | ALDH1A1MEN1KMT2A | |
| SCHEMBL5964023 | 0.78 | CYP3A4 (0.48) | CYP3A4CYP1A2CYP2C19CYP2D6ALOX15 | |
| SCHEMBL26739769 | 0.77 | CYP1A2 (0.50) | CYP3A4CYP1A2CYP2C19CYP2D6ALOX15 | |
| SCHEMBL2406803 | 0.76 | ALOX5AP (0.48) | CYP3A4CYP1A2CYP2C19CYP2D6ALOX15 | |
| SCHEMBL15060623 | 0.75 | CYP3A4 (0.44) | CYP3A4CYP1A2CYP2C19CYP2D6ALOX15 | |
| SCHEMBL5964127 | 0.75 | KIF11 (0.53) | CYP3A4CYP1A2CYP2C19CYP2D6ALOX15 | |
| SCHEMBL905134 | 0.74 | CYP1A2 (0.51) | CYP3A4CYP1A2CYP2C19CYP2D6ALOX15 | |
| SCHEMBL3152503 | 0.73 | CCR1 (0.46) | CYP3A4ALOX15HSD17B10ALDH1A1PTPN1 | |
| SCHEMBL5964032 | 0.73 | OXTR (0.48) | CYP3A4CYP1A2MAPK1KMT2AATR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012043891-A1 | AGENT FOR TREATMENT OF EYE DISEASES | ダイトーケミックス株式会社 (JP) | 2012-04-05 | — | — | WO | disclosed |
| WO-2012014994-A1 | NAPHTHALENE DERIVATIVE | ダイトーケミックス株式会社 (JP) | 2012-02-02 | — | — | WO | disclosed |