Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.34 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7922360 | 0.85 | MAOB (0.45) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL7922463 | 0.85 | NPC1 (0.34) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL1390757 | 0.82 | ALDH1A1 (0.43) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL10239177 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL7926417 | 0.77 | TSHR (0.50) | ALDH1A1TSHRNPC1RAB9APPARD | |
| SCHEMBL1390564 | 0.76 | TSHR (0.49) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL17338672 | 0.73 | ALDH1A1 (0.51) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL22548867 | 0.72 | MAOB (0.37) | ALDH1A1RAB9AKMT2AMEN1MAPT | |
| SCHEMBL17347205 | 0.69 | MAOB (0.61) | ALDH1A1TSHRNPC1RAB9AKMT2A | |
| SCHEMBL22549667 | 0.69 | MAOB (0.40) | NPC1RAB9AKMT2AMEN1POLB |
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 |