Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9031895 | 1.00 | ALDH1A1 (0.49) | ALDH1A1NPC1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9031929 | 0.85 | PPARG (0.40) | ALDH1A1NPC1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9031920 | 0.85 | PPARG (0.40) | ALDH1A1NPC1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9031995 | 0.82 | ALDH1A1 (0.40) | ALDH1A1NPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL9032002 | 0.82 | ALDH1A1 (0.40) | ALDH1A1NPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL9031410 | 0.80 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL9031417 | 0.80 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL9032169 | 0.77 | ALDH1A1 (0.43) | ALDH1A1NPC1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9030724 | 0.77 | PPARG (0.40) | ALDH1A1SMN1; SMN2PKMMEN1KMT2A | |
| SCHEMBL9030719 | 0.77 | PPARG (0.40) | ALDH1A1SMN1; SMN2PKMMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0558287-B1 | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO LTD (JP) | 1996-12-04 | — | — | EP | disclosed |
| US-5292767-A | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1994-03-08 | — | — | US | disclosed |
| EP-0558287-A1 | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 1993-09-01 | — | — | EP | disclosed |