Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 8/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MCOLN3 | Q8TDD5 | 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 | |
|---|---|---|---|---|
| SCHEMBL3578338 | 0.82 | ALDH1A1 (0.48) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL3823448 | 0.80 | ALDH1A1 (0.54) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL8842590 | 0.79 | MAPK1 (0.45) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL3574940 | 0.79 | ALDH1A1 (0.50) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL28712089 | 0.79 | ALDH1A1 (0.53) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL3819554 | 0.78 | ALDH1A1 (0.48) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL4667892 | 0.78 | ALDH1A1 (0.49) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL430628 | 0.77 | ALDH1A1 (0.51) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL177095 | 0.77 | ALDH1A1 (0.51) | ALDH1A1MAPK1MAPTLMNANPC1 | |
| SCHEMBL257715 | 0.77 | ALDH1A1 (0.51) | ALDH1A1MAPK1MAPTLMNANPC1 |
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-5688803-A | BRAIN DISORDERS; PSYCHOLOGICAL DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1997-11-18 | — | — | US | disclosed |