Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | ACHE | P22303 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10551668 | 0.79 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL15797521 | 0.75 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL18274496 | 0.75 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL10550033 | 0.74 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL10550925 | 0.74 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL9363512 | 0.73 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL9162336 | 0.73 | ALDH1A1 (0.83) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL3114045 | 0.72 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL18240274 | 0.72 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A | |
| SCHEMBL18274507 | 0.72 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2ACHEL3MBTL1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4954494-A | Cardiotonic and inotropic agents | RORER PHARMACEUTICAL CORPORATION (US) | 1990-09-04 | — | — | US | disclosed |
| US-4847251-A | CARDIOVASCULAR DISORDERS | BOEHRINGER MANNHEIM GMBH (DE) | 1989-07-11 | — | — | US | disclosed |
| US-4826835-A | INOTROPIC AGENTS | RORER PHARMACEUTICAL CORPORATION (US) | 1989-05-02 | — | — | US | disclosed |
| EP-0255704-A2 | Pyridazinone derivatives, process for their preparation and their use as medicines | Roche Diagnostics GmbH (DE) | 1988-02-10 | — | — | EP | disclosed |