Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | HPGD | P15428 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.43 |
| ▸ | STS | P08842 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.38 |
| ▸ | CDK9 | P50750 | 2/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9160443 | 1.00 | ALDH1A1 (0.61) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9162712 | 0.85 | ALDH1A1 (0.61) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9166530 | 0.82 | ALDH1A1 (0.61) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9166526 | 0.82 | ALDH1A1 (0.61) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9164440 | 0.80 | ALDH1A1 (0.68) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9164443 | 0.80 | ALDH1A1 (0.68) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9164212 | 0.76 | KDM4E (0.50) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL9159332 | 0.72 | MAOA (0.43) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL435366 | 0.72 | HPGD (1.00) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT | |
| SCHEMBL2465240 | 0.72 | HPGD (1.00) | ALDH1A1HPGDSMN1; SMN2KDM4EMAPT |
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-5409952-A | Anticancer agents | ADIR ET COMPAGNIE (FR) | 1995-04-25 | — | — | US | disclosed |