Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.62 |
| ▸ | HPGD | P15428 | 6/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 5/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9194478 | 0.91 | ALDH1A1 (0.75) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9397296 | 0.91 | ALDH1A1 (0.69) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9200623 | 0.90 | ALDH1A1 (0.75) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9197922 | 0.89 | ALDH1A1 (0.60) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9198961 | 0.88 | ALDH1A1 (0.63) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9192720 | 0.84 | KDM4E (0.67) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL13888998 | 0.83 | ALDH1A1 (0.64) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9200540 | 0.82 | ALDH1A1 (0.67) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9195860 | 0.81 | ALDH1A1 (0.83) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 | |
| SCHEMBL9193433 | 0.81 | ALDH1A1 (0.67) | ALDH1A1HPGDKDM4ECYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5340811-A | Bronchodilator agent | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1994-08-23 | — | — | US | disclosed |
| EP-0471841-A1 | SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1992-02-26 | — | — | EP | disclosed |