Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.61 |
| ▸ | NPC1 | O15118 | 7/20 | 0.61 |
| ▸ | PKM | P14618 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.56 |
| ▸ | RELA | Q04206 | 1/20 | 0.56 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.47 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.47 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.47 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2854348 | 0.90 | RAB9A (0.54) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 | |
| SCHEMBL2852384 | 0.89 | NPC1 (0.54) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 | |
| SCHEMBL2860400 | 0.88 | RAB9A (0.53) | RAB9ANPC1PKMSMN1; SMN2CYP1A2 | |
| SCHEMBL2857558 | 0.87 | NPC1 (0.50) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 | |
| SCHEMBL2853093 | 0.87 | NPC1 (0.52) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 | |
| SCHEMBL2855794 | 0.85 | RAB9A (0.48) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 | |
| SCHEMBL2852417 | 0.84 | MAPT (0.49) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 | |
| SCHEMBL2860234 | 0.83 | HPGD (0.54) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 | |
| SCHEMBL2848335 | 0.82 | ATM (0.54) | RAB9ANPC1PKMSMN1; SMN2MAPT | |
| SCHEMBL2859099 | 0.82 | NPC1 (0.50) | RAB9ANPC1PKMALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |