Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | IDO1 | P14902 | 4/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL11962884 | 0.84 | ACHE (0.44) | MAPTALDH1A1HTTMEN1KMT2A | |
| SCHEMBL11951582 | 0.80 | MAPT (0.48) | MAPTALDH1A1HTTMEN1KMT2A | |
| SCHEMBL22897889 | 0.80 | IDO1 (0.47) | MAPTALDH1A1HTTIDO1MEN1 | |
| SCHEMBL29559654 | 0.80 | IDO1 (0.47) | MAPTALDH1A1HTTIDO1MEN1 | |
| SCHEMBL31280496 | 0.79 | HDAC3 (0.43) | MAPTALDH1A1HTTIDO1HDAC3 | |
| SCHEMBL11894475 | 0.78 | ALDH1A1 (0.56) | MAPTALDH1A1HTTMEN1KMT2A | |
| SCHEMBL1715889 | 0.76 | IDO1 (0.61) | MAPTHTTIDO1HDAC3HDAC1 | |
| SCHEMBL29559868 | 0.75 | HTR2A (0.44) | MAPTALDH1A1HTTMEN1KMT2A | |
| SCHEMBL1941937 | 0.75 | REN (0.39) | ALDH1A1HDAC3HDAC1HDAC2HDAC6 | |
| Hydrochloric Acid SCHEMBL1714849 | 0.75 | IDO1 (0.62) | MAPTHTTIDO1MAPK1AGXT |
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-3056495-A1 | PYRROLOPYRAZINE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | Vertex Pharmaceuticals Inc. (US) | 2016-08-17 | — | — | EP | disclosed |