Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | WNT3A | P56704 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10441731 | 0.85 | ALDH1A1 (0.51) | ALDH1A1MAPK1SRD5A2NPC1RAB9A | |
| SCHEMBL5794655 | 0.80 | ALDH1A1 (0.46) | ALDH1A1MAPK1SRD5A2NPC1RAB9A | |
| SCHEMBL4329257 | 0.79 | KMT2A (0.48) | ALDH1A1MAPK1KIF11CYP3A4MEN1 | |
| SCHEMBL10544610 | 0.78 | MEN1 (0.49) | ALDH1A1MAPK1SRD5A2NPC1RAB9A | |
| SCHEMBL29043606 | 0.78 | ALDH1A1 (0.47) | ALDH1A1MAPK1SRD5A2NPC1RAB9A | |
| SCHEMBL22147339 | 0.77 | ALDH1A1 (0.44) | ALDH1A1MAPK1SRD5A2NPC1RAB9A | |
| SCHEMBL933157 | 0.77 | CYP3A4 (0.50) | ALDH1A1MAPK1NPC1RAB9ATRPV1 | |
| SCHEMBL25689969 | 0.77 | ALDH1A1 (0.50) | ALDH1A1MAPK1SRD5A2NPC1RAB9A | |
| SCHEMBL30567467 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MAPK1TRPV1CYP3A4SMN1; SMN2 | |
| SCHEMBL85405 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MAPK1TRPV1CYP3A4SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6136843-A | CARDIOVASCULAR DISORDERS; KIDNEY DISORDERS | PFIZER INC (US) | 2000-10-24 | — | — | US | disclosed |
| US-5731434-A | CARDIOVASCULAR DISORDERS | ABBOTT LABORATORIES (US) | 1998-03-24 | — | — | US | disclosed |