Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | REV1 | Q9UBZ9 | 1/20 | 0.45 |
| ▸ | GPR183 | P32249 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.43 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP14 | P50281 | 1/20 | 0.42 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4887148 | 0.90 | KMT2A (0.43) | KMT2ANPC1REV1GPR183MAPT | |
| SCHEMBL13901032 | 0.89 | MAPT (0.44) | KMT2ANPC1REV1GPR183MAPT | |
| SCHEMBL4890133 | 0.84 | KMT2A (0.57) | KMT2ANPC1ALDH1A1ABCB1MEN1 | |
| SCHEMBL29097908 | 0.81 | NR4A2 (0.53) | NPC1SMN1; SMN2NR4A2MAOB | |
| SCHEMBL3895504 | 0.81 | MAOB (0.42) | NR4A2ADAMTS4MMP13MMP1MMP2 | |
| Hydrochloric Acid SCHEMBL3903185 | 0.80 | MAOB (0.42) | NR4A2ADAMTS4MMP13MMP1MMP2 | |
| SCHEMBL5565059 | 0.77 | NPC1 (0.56) | NPC1SMN1; SMN2NR4A2MAOB | |
| SCHEMBL3900360 | 0.76 | ESR2 (0.47) | KMT2AREV1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL3905464 | 0.74 | MAOB (0.47) | MAPTNR4A2ADAMTS4MMP13MMP1 | |
| Hydrochloric Acid SCHEMBL3900182 | 0.73 | MAOB (0.47) | MAPTNR4A2ADAMTS4MMP13MMP1 |
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-1511727-A2 | AROMATIC SULFONES AND THEIR MEDICAL USE | GLAXO GROUP LIMITED (GB) | 2005-03-09 | — | — | EP | disclosed |
| WO-2003099786-A2 | AROMATIC SULFONES AND THEIR MEDICAL USE | GLAXO GROUP LIMITED (GB) | 2003-12-04 | — | — | WO | disclosed |