Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | EGLN1 | Q9GZT9 | 4/20 | 0.42 |
| ▸ | COMT | P21964 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3249138 | 0.84 | ALDH1A1 (0.58) | ALDH1A1NPSR1MAPTSMN1; SMN2EGLN1 | |
| SCHEMBL9873674 | 0.84 | KMT2A (0.42) | ALDH1A1KMT2AHTTNPSR1MAPT | |
| Hydrochloric Acid SCHEMBL11567115 | 0.83 | ALDH1A1 (0.57) | ALDH1A1NPSR1MAPTSMN1; SMN2EGLN1 | |
| SCHEMBL10877533 | 0.80 | ALDH1A1 (0.45) | ALDH1A1KMT2ANPSR1EGLN1NPC1 | |
| SCHEMBL10877535 | 0.80 | PARP1 (0.51) | ALDH1A1EGLN1HPGD | |
| SCHEMBL12564546 | 0.80 | ALDH1A1 (0.45) | ALDH1A1KMT2AMAPTEGLN1MEN1 | |
| SCHEMBL11729968 | 0.80 | ALDH1A1 (0.45) | ALDH1A1KMT2AHTTMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11567111 | 0.78 | ALDH1A1 (0.44) | ALDH1A1KMT2AHTTMAPTSMN1; SMN2 | |
| SCHEMBL6487277 | 0.77 | ALDH1A1 (0.71) | ALDH1A1FEN1EGLN1LMNAALOX12 | |
| SCHEMBL31023212 | 0.77 | ALDH1A1 (0.71) | ALDH1A1FEN1EGLN1LMNAALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| US-5026711-A | Prevention and treatment of cardiovascular disorders and infections states; anxiolytic and anti-allergic agents | SANOFI (FR) | 1991-06-25 | — | — | US | disclosed |