Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | AQP3 | Q92482 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7592187 | 0.87 | ALDH1A1 (0.31) | ALDH1A1MEN1CYP2C9CYP2C19KMT2A | |
| SCHEMBL20594351 | 0.78 | ALDH1A1 (0.37) | ALDH1A1MEN1CYP2C9CYP2C19KMT2A | |
| SCHEMBL6360972 | 0.78 | — | — | |
| SCHEMBL2486985 | 0.78 | ALDH1A1 (0.33) | ALDH1A1CYP2C9CYP2C19USP2GAA | |
| SCHEMBL4805438 | 0.75 | KDM4E (0.32) | ALDH1A1CYP2C9CYP2C19GAACYP1A2 | |
| SCHEMBL10706815 | 0.75 | ALDH1A1 (0.31) | ALDH1A1USP2GAAMAPTTDP1 | |
| SCHEMBL7595344 | 0.74 | — | — | |
| SCHEMBL2125652 | 0.74 | ALDH1A1 (0.36) | ALDH1A1USP2GAAMAPTTDP1 | |
| SCHEMBL24132476 | 0.73 | CYP1A2 (0.48) | ALDH1A1MEN1CYP2C9CYP2C19KMT2A | |
| Methoxymethane SCHEMBL21931862 | 0.71 | ALDH1A1 (0.35) | ALDH1A1MEN1CYP2C9CYP2C19KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103937328-B | Cycylohexyl-mannitol diketal derivatives as vehicle modifiers and gelators | 施乐公司 | 2017-02-08 | — | — | CN | disclosed |
| EP-0893442-B1 | LYMPH-ABSORBABLE IMIDAZOLE DERIVATIVES | SHIONOGI & CO (JP) | 2005-01-12 | — | — | EP | disclosed |
| US-6054591-A | LYMPHOTROPIC ANTI-AIDS AGENT | SHIONOGI & CO., LTD. (JP) | 2000-04-25 | — | — | US | disclosed |
| EP-0893442-A1 | LYMPH-ABSORBABLE IMIDAZOLE DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 1999-01-27 | — | — | EP | disclosed |