Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | APP | P05067 | 2/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7164883 | 0.90 | BACE1 (0.56) | MAPTGAAKDM4EALDH1A1HPGD | |
| SCHEMBL396451 | 0.84 | BACE1 (0.65) | MAPTGAAHTTKDM4EALDH1A1 | |
| SCHEMBL29922357 | 0.84 | BACE1 (0.65) | MAPTGAAHTTKDM4EALDH1A1 | |
| SCHEMBL9134263 | 0.81 | HDAC1 (0.49) | MAPTKDM4EALDH1A1APPBACE1 | |
| SCHEMBL95038 | 0.81 | MAPT (0.55) | MAPTGAAKDM4EALDH1A1APP | |
| SCHEMBL17177679 | 0.81 | MEN1 (0.68) | MAPTGAAKDM4EALDH1A1HPGD | |
| SCHEMBL13941341 | 0.81 | ALDH1A1 (0.55) | TDP1KDM4EALDH1A1HPGDAPP | |
| SCHEMBL8405018 | 0.81 | HDAC1 (0.62) | MAPTGAATDP1HTTKDM4E | |
| SCHEMBL15675233 | 0.80 | HDAC1 (0.56) | KDM4EALDH1A1HPGDBACE1HDAC1 | |
| SCHEMBL21427815 | 0.80 | BACE1 (0.73) | HTTKDM4EALDH1A1HPGDAPP |
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-0151826-A1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1985-08-21 | — | — | EP | disclosed |