Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | THRA | P10827 | 5/20 | 0.39 |
| ▸ | THRB | P10828 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.37 |
| ▸ | CDK1 | P06493 | 2/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.37 |
| ▸ | MDH2 | P40926 | 2/20 | 0.37 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.37 |
| ▸ | WNT3A | P56704 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11567792 | 0.89 | AKR1B1 (0.52) | AKR1B1MAPK14ALDH1A1CTNNB1WNT3A | |
| SCHEMBL11567084 | 0.85 | AKR1B1 (0.54) | AKR1B1MAPK14ALDH1A1CTNNB1WNT3A | |
| SCHEMBL11824625 | 0.83 | AKR1B1 (0.64) | AKR1B1MAPK14LMNAALDH1A1PTPN11 | |
| SCHEMBL11827878 | 0.83 | AKR1B1 (0.64) | AKR1B1MAPK14LMNAALDH1A1PTPN11 | |
| SCHEMBL11570278 | 0.83 | AKR1B1 (0.64) | AKR1B1MAPK14LMNAALDH1A1PTPN11 | |
| SCHEMBL11570176 | 0.83 | AKR1B1 (0.64) | AKR1B1MAPK14LMNAALDH1A1PTPN11 | |
| SCHEMBL11846250 | 0.83 | AKR1B1 (0.55) | AKR1B1MAPK14LMNA | |
| SCHEMBL11842537 | 0.83 | AKR1B1 (0.55) | AKR1B1MAPK14LMNA | |
| SCHEMBL11839180 | 0.83 | AKR1B1 (0.55) | AKR1B1MAPK14LMNA | |
| SCHEMBL11853431 | 0.82 | AKR1B1 (0.56) | AKR1B1MAPK14 |
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 |