Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 4/20 | 0.37 |
| ▸ | MAOA | P21397 | 3/20 | 0.37 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | ACACA | Q13085 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL7927004 | 0.92 | MAOB (0.43) | KMT2ARAB9ANPC1ALDH1A1PPARD | |
| SCHEMBL1390614 | 0.90 | ACACB (0.47) | KMT2ARAB9ANPC1HSP90AA1ALDH1A1 | |
| SCHEMBL7921607 | 0.89 | MAOB (0.40) | KMT2ARAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7922328 | 0.87 | PPARD (0.36) | KMT2APPARDPPARAMAOBMAOA | |
| SCHEMBL7917892 | 0.86 | NPC1 (0.41) | KMT2ARAB9ANPC1SMN1; SMN2PPARD | |
| SCHEMBL1390694 | 0.81 | MTNR1A (0.47) | NPC1PPARDPPARAMAOBMAOA | |
| SCHEMBL1390645 | 0.78 | MTNR1A (0.46) | KMT2ARAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1390991 | 0.77 | PPARD (0.40) | KMT2AALDH1A1PPARDPPARAMAOB | |
| SCHEMBL1390488 | 0.76 | ACACB (0.47) | NPC1SMN1; SMN2PPARDPPARAMAOB | |
| SCHEMBL1390697 | 0.75 | ACACA (0.60) | ACACBACACA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010050445-A1 | BICYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2010-05-06 | — | — | WO | disclosed |