Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.80 |
| ▸ | GAA | P10253 | 5/20 | 0.80 |
| ▸ | MAPT | P10636 | 4/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.64 |
| ▸ | XDH | P47989 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7265202 | 0.93 | ALDH1A1 (0.80) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL9570228 | 0.91 | ALDH1A1 (0.96) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL16360634 | 0.86 | ALDH1A1 (0.60) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL1531318 | 0.86 | GAA (0.60) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL1531317 | 0.86 | GAA (0.60) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL20681622 | 0.84 | KDM4E (0.62) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL1021357 | 0.84 | KDM4E (0.62) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL8134520 | 0.81 | ALDH1A1 (0.73) | ALDH1A1GAAMAPTKDM4EXDH | |
| SCHEMBL12144355 | 0.80 | GAA (0.57) | ALDH1A1GAAMAPTKDM4EHTT | |
| SCHEMBL5254927 | 0.80 | KDM4E (0.66) | ALDH1A1GAAMAPTKDM4EXDH |
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-2012001107-A1 | PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-05 | — | — | WO | disclosed |