Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | RECQL | P46063 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | AKT1 | P31749 | 1/20 | 0.51 |
| ▸ | CNKSR1 | Q969H4 | 1/20 | 0.51 |
| ▸ | AKR1B1 | P15121 | 11/20 | 0.50 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.49 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.49 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9218605 | 0.86 | AKR1B1 (0.65) | AKR1B1AKR1B10AKR1A1GLO1CYP1A2 | |
| SCHEMBL8201334 | 0.81 | AKR1B1 (0.78) | AKR1B1AKR1B10AKR1A1GLO1 | |
| SCHEMBL11162987 | 0.79 | AKR1B1 (0.74) | ALDH1A1RECQLSMN1; SMN2SLC6A4L3MBTL1 | |
| SCHEMBL11166552 | 0.79 | ALDH1A1 (0.64) | ALDH1A1RECQLSMN1; SMN2HTR2AHTR2C | |
| SCHEMBL11170511 | 0.79 | ALDH1A1 (0.67) | ALDH1A1RECQLSMN1; SMN2HTR2AHTR2C | |
| SCHEMBL9217271 | 0.79 | ALDH1A1 (0.67) | ALDH1A1RECQLSMN1; SMN2HTR2AHTR2C | |
| SCHEMBL9210985 | 0.79 | ALDH1A1 (0.67) | ALDH1A1RECQLSMN1; SMN2HTR2AHTR2C | |
| SCHEMBL9201748 | 0.77 | SLC6A4 (0.65) | ALDH1A1RECQLSMN1; SMN2HTR2AHTR2C | |
| SCHEMBL9207026 | 0.77 | ALDH1A1 (0.67) | ALDH1A1RECQLSMN1; SMN2HTR2AHTR2C | |
| SCHEMBL9198976 | 0.77 | AKR1B1 (0.78) | ALDH1A1RECQLSMN1; SMN2HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995003053-A1 | OXOPHTHALAZINES FOR TREATING CACHEXIA | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-02-02 | — | — | WO | disclosed |