Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | HBB | P68871 | 1/20 | 0.35 |
| ▸ | EDNRB | P24530 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9150579 | 0.87 | ALDH1A1 (0.38) | ALDH1A1CYP3A4TSHRACHEKDM4E | |
| SCHEMBL11698952 | 0.79 | SHBG (0.39) | ALDH1A1CYP3A4ACHEKDM4EGAA | |
| SCHEMBL11698407 | 0.77 | CYP3A4 (0.54) | ALDH1A1CYP3A4TSHRACHEKDM4E | |
| SCHEMBL30970296 | 0.74 | NPSR1 (0.67) | ALDH1A1CYP3A4KDM4ECYP1A2CYP2D6 | |
| SCHEMBL9146721 | 0.74 | NPSR1 (0.67) | ALDH1A1CYP3A4KDM4ECYP1A2CYP2D6 | |
| SCHEMBL6967405 | 0.73 | MEN1 (0.40) | ALDH1A1CYP3A4TSHRCYP2D6MEN1 | |
| SCHEMBL13754300 | 0.72 | ACHE (0.41) | ALDH1A1CYP3A4TSHRACHEKDM4E | |
| SCHEMBL14552349 | 0.72 | FASN (0.48) | ALDH1A1CYP3A4HPGDFASN | |
| SCHEMBL5809247 | 0.71 | CALM1 (0.62) | ALDH1A1CYP3A4GAACYP2D6CALM1 | |
| SCHEMBL30101936 | 0.71 | CALM1 (0.62) | ALDH1A1CYP3A4GAACYP2D6CALM1 |
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 |