Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA4 | P22748 | 2/20 | 0.52 |
| ▸ | CA7 | P43166 | 2/20 | 0.52 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4801310 | 0.83 | AKR1C3 (0.67) | ALDH1A1L3MBTL1KDM4EHTR6MAPT | |
| SCHEMBL979463 | 0.81 | ALDH1A1 (0.67) | ALDH1A1L3MBTL1GLAPOLBTDP1 | |
| Orazipone SCHEMBL1649524 | 0.80 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1GLAPOLBTDP1 | |
| SCHEMBL9315389 | 0.79 | ALDH1A1 (0.82) | ALDH1A1L3MBTL1GLAPOLBTDP1 | |
| SCHEMBL28273258 | 0.77 | AKR1C3 (0.61) | ALDH1A1L3MBTL1GLAPOLBTDP1 | |
| SCHEMBL19397776 | 0.77 | FBP1 (0.72) | ALDH1A1HTR6MAPTGAALMNA | |
| SCHEMBL17558901 | 0.77 | FBP1 (0.72) | ALDH1A1HTR6MAPTGAALMNA | |
| SCHEMBL17558902 | 0.77 | FBP1 (0.72) | ALDH1A1HTR6MAPTGAALMNA | |
| (Phenylsulfonyl)Benzene SCHEMBL29058880 | 0.77 | HTR6 (0.74) | ALDH1A1L3MBTL1POLBKDM4EHTR6 | |
| (Phenylsulfonyl)Benzene SCHEMBL2381369 | 0.77 | HTR6 (0.74) | ALDH1A1L3MBTL1POLBKDM4EHTR6 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0440324-B1 | Substituted beta-diketones and their use in the treatment of inflammatory bowel disease | ORION YHTYMAE OY (FI) | 2000-04-12 | — | — | EP | claimed |
| EP-0440324-A2 | Substituted beta-diketones and their use | ORION-YHTYMÀ OY (FI) | 1991-08-07 | — | — | EP | claimed |
| EP-0440324-B1 | Substituted beta-diketones and their use in the treatment of inflammatory bowel disease | ORION YHTYMAE OY (FI) | 2000-04-12 | — | — | EP | disclosed |
| US-5292771-A | Treating inflammatory bowel disease | ORION-YHTYMA OY (FI) | 1994-03-08 | — | — | US | disclosed |
| US-5185370-A | Substituted β-diketones and their use | ORION-YHTYMA OY (FI) | 1993-02-09 | — | — | US | disclosed |
| EP-0440324-A2 | Substituted beta-diketones and their use | ORION-YHTYMÀ OY (FI) | 1991-08-07 | — | — | EP | disclosed |