Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10534396 | 0.92 | ALDH1A1 (0.50) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL1520419 | 0.87 | MEN1 (0.48) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL6436185 | 0.83 | MAPT (0.46) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL9148307 | 0.81 | NPSR1 (0.48) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL28587493 | 0.81 | ALDH1A1 (0.45) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL11229391 | 0.79 | ALDH1A1 (0.46) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL7813652 | 0.79 | ALDH1A1 (0.46) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL29061284 | 0.79 | CYP3A4 (0.44) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL4576468 | 0.79 | SLC22A12 (0.50) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A | |
| SCHEMBL19753259 | 0.79 | PKM (0.47) | ALDH1A1CYP3A4CYP1A2CYP2C19RAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5475024-A | Useful in treating liver disease | EISAI CO., LTD. (JP) | 1995-12-12 | — | — | US | disclosed |
| US-5292901-A | Benzodioxole derivatives | EISAI CO., LTD. (JP) | 1994-03-08 | — | — | US | disclosed |
| EP-0281098-B1 | BENZODIOXOLE DERIVATIVES, COMPOSITIONS COMPRISING THE SAME, AND THE USE OF THE SAME FOR THE MANUFACTURE OF MEDICAMENTS | Eisai Co., Ltd. (JP) | 1992-11-25 | — | — | EP | disclosed |
| US-5110956-A | Liver disorders | EISAI CO., LTD. (JP) | 1992-05-05 | — | — | US | disclosed |
| EP-0281098-A1 | Benzodioxole derivatives, compositions comprising the same, and the use of the same for the manufacture of medicaments | Eisai Co., Ltd. (JP) | 1988-09-07 | — | — | EP | disclosed |