Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | METAP1 | P53582 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11563438 | 0.87 | AKR1B1 (0.47) | AKR1B1METAP1KMT2AMEN1NPC1 | |
| SCHEMBL11566471 | 0.86 | AKR1B1 (0.60) | AKR1B1GSK3BSRD5A1SRD5A2KDM4E | |
| SCHEMBL11566981 | 0.86 | AKR1B1 (0.44) | AKR1B1METAP1KMT2AMEN1NPC1 | |
| SCHEMBL11658676 | 0.86 | SRD5A2 (0.55) | AKR1B1METAP1KMT2AMEN1NPC1 | |
| SCHEMBL11659100 | 0.85 | AKR1B1 (0.41) | AKR1B1METAP1KMT2AMEN1NPC1 | |
| SCHEMBL11658398 | 0.84 | CA12 (0.45) | AKR1B1METAP1KMT2AMEN1RAB9A | |
| SCHEMBL11639600 | 0.81 | LMNA (0.41) | AKR1B1METAP1KMT2AMEN1NPC1 | |
| SCHEMBL11568284 | 0.81 | AKR1B1 (0.38) | AKR1B1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL11566764 | 0.79 | AKR1B1 (0.39) | AKR1B1METAP1KMT2AMEN1NPC1 | |
| SCHEMBL11575230 | 0.78 | AKR1B1 (0.38) | AKR1B1METAP1KMT2AMEN1NPC1 |
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-0003422-A1 | Novel 4-(8X-6,11-dihydrodibenzo-(b,e)-thiepin-11-one-3-yl)-4-oxobutyric acids, methods of preparation, compositions and uses thereof | SYNTEX (U.S.A.) INC. (US) | 1979-08-08 | — | — | EP | disclosed |
| US-4130654-A | ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, FRIBRINOLYTIC, MUSCLE RELAXANT | SYNTEX (U.S.A.) INC. (US) | 1978-12-19 | — | — | US | disclosed |