Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP9 | P14780 | 2/20 | 0.36 |
| ▸ | MMP12 | P39900 | 2/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | MMP15 | P51511 | 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 | |
|---|---|---|---|---|
| SCHEMBL10911181 | 1.00 | ALDH1A1 (0.47) | ALDH1A1MAPTHDAC3HDAC4HDAC1 | |
| SCHEMBL10353455 | 0.84 | HDAC3 (0.49) | ALDH1A1MAPTHDAC3HDAC4HDAC1 | |
| SCHEMBL9780324 | 0.83 | ALDH1A1 (0.40) | ALDH1A1MAPTHDAC3HDAC4HDAC1 | |
| SCHEMBL8775491 | 0.78 | CHRM2 (0.53) | ALDH1A1MAPTHDAC3HDAC4HDAC1 | |
| SCHEMBL7325551 | 0.78 | LMNA (0.53) | MAPTHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9780294 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MAPTHSP90AA1HSP90AB1HSD17B10 | |
| SCHEMBL9780297 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MAPTHSP90AA1HSP90AB1HSD17B10 | |
| SCHEMBL8823315 | 0.77 | PGR (0.52) | ALDH1A1MAPTMMP2MMP9MMP12 | |
| SCHEMBL135357 | 0.77 | PGR (0.52) | ALDH1A1MAPTMMP2MMP9MMP12 | |
| SCHEMBL8381806 | 0.76 | MAPT (0.44) | ALDH1A1MAPTHDAC3HDAC4HDAC1 |
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-0206741-B1 | LEUKOTRIENE ANTAGONISTS | MERCK FROSST CANADA INC. (CA) | 1991-04-10 | — | — | EP | disclosed |
| US-4990526-A | Skin disorders, antiallergens, antiinflammatory agents | MERCK FROSST CANADA, INC. (CA) | 1991-02-05 | — | — | US | disclosed |
| EP-0206741-A2 | Leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1986-12-30 | — | — | EP | disclosed |