Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10407004 | 0.89 | TSHR (0.43) | ALDH1A1KMT2ATSHRCYP3A4CYP2D6 | |
| SCHEMBL9528175 | 0.86 | SMN1; SMN2 (0.40) | ALDH1A1KMT2ATSHRCYP3A4CYP2D6 | |
| SCHEMBL10407865 | 0.86 | ALDH1A1 (0.44) | ALDH1A1KMT2ATSHRCYP3A4CYP2D6 | |
| SCHEMBL10733327 | 0.85 | TSHR (0.47) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL10406930 | 0.80 | ALDH1A1 (0.46) | ALDH1A1KMT2ATSHRSMN1; SMN2RAB9A | |
| SCHEMBL9532053 | 0.80 | NPC1 (0.43) | ALDH1A1KMT2ATSHRCYP3A4CYP2D6 | |
| SCHEMBL9529021 | 0.77 | SMN1; SMN2 (0.37) | ALDH1A1KMT2ACYP3A4CYP2D6CYP2C19 | |
| SCHEMBL9528114 | 0.76 | CYP2C9 (0.39) | ALDH1A1KMT2ATSHRCYP3A4CYP2D6 | |
| SCHEMBL10407326 | 0.76 | CYP2C19 (0.47) | ALDH1A1CYP3A4CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL10406927 | 0.74 | ALDH1A1 (0.44) | ALDH1A1KMT2AL3MBTL1SMN1; SMN2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0366006-B1 | PYRIDYLKETOXIME ETHER COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING IT | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 1993-09-29 | — | — | EP | disclosed |
| US-4971985-A | ANTIISCHEMIC AGENTS, CARDIOVASCULAR DISORDERS | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 1990-11-20 | — | — | US | disclosed |