Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8553478 | 0.85 | MAPT (0.37) | ALDH1A1TSHRALOX15LMNAMAPT | |
| SCHEMBL8192418 | 0.85 | HSP90AA1 (0.38) | ALDH1A1TSHRALOX15LMNAMAPT | |
| SCHEMBL8552755 | 0.77 | KDM4E (0.43) | ALDH1A1LMNAMAPTGAAMEN1 | |
| SCHEMBL8551076 | 0.70 | CNR2 (0.41) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL8552959 | 0.69 | KDM4E (0.43) | ALDH1A1LMNAMAPTPOLBGAA | |
| Hexanoate SCHEMBL8550591 | 0.63 | CNR2 (0.39) | ALDH1A1TSHRMAPTUSP2POLB | |
| SCHEMBL8708853 | 0.61 | CNR2 (0.41) | ALDH1A1MAPTPOLBHPGDGFER | |
| SCHEMBL8197371 | 0.61 | NPC1 (0.49) | ALDH1A1HPGDGFERMEN1KMT2A | |
| SCHEMBL8552304 | 0.60 | CA9 (0.39) | — | |
| SCHEMBL7141353 | 0.59 | HTR1F (0.36) | ALDH1A1LMNAMAPTMAPK1GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998015545-A1 | NEW SEROTONIN 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 1998-04-16 | — | — | WO | disclosed |
| EP-0835869-A2 | New serotonin 5-HT1F agonists | ELI LILLY AND COMPANY (US) | 1998-04-15 | — | — | EP | disclosed |