Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.71 |
| ▸ | MAPT | P10636 | 3/20 | 0.69 |
| ▸ | MEN1 | O00255 | 2/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.69 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | CDC25B | P30305 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | FNTA | P49354 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27634042 | 0.90 | ALDH1A1 (0.81) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL9341973 | 0.88 | ALDH1A1 (0.78) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL19604507 | 0.84 | SMN1; SMN2 (0.89) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL4533753 | 0.82 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL19599377 | 0.81 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL19604508 | 0.79 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL10844866 | 0.78 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL10938116 | 0.78 | AKR1C3 (0.65) | ALDH1A1MAPTAKR1C3CDC25BATM | |
| SCHEMBL472751 | 0.78 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL5491735 | 0.78 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A |
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-4629798-A | FROM VINYLENE ESTEPS, KETONES, OR NITRILES AND TOSYLMETHYLISOCYANIDE | THE B. F. GOODRICH COMPANY (US) | 1986-12-16 | — | — | US | disclosed |
| US-4543402-A | POLYPYRROLES AS SEMICONDUCTORS | THE B. F. GOODRICH COMPANY (US) | 1985-09-24 | — | — | US | disclosed |