Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5086481 | 0.78 | ALDH1A1 (0.48) | ALDH1A1MAPTGAARXFP1AKR1C3 | |
| SCHEMBL7445710 | 0.77 | ALDH1A1 (0.52) | ALDH1A1MAPTGAAAKR1C3AKR1C2 | |
| SCHEMBL5085691 | 0.73 | PTPN5 (0.34) | MAOB | |
| SCHEMBL4427520 | 0.73 | TSHR (0.35) | ALDH1A1MAPTGAARXFP1AKR1C3 | |
| SCHEMBL680656 | 0.72 | TSHR (0.62) | ALDH1A1MAPTSMN1; SMN2TSHRLMNA | |
| SCHEMBL7433808 | 0.71 | SKP2 (0.47) | ALDH1A1MAPTGAAAKR1C3AKR1C2 | |
| SCHEMBL7439484 | 0.71 | PDE4A (0.71) | ALDH1A1MAPTPDE4APDE4BNPC1 | |
| SCHEMBL7441450 | 0.70 | KCNH2 (0.45) | ALDH1A1MAPTGAAAKR1C3AKR1C2 | |
| Dinitrophenylene SCHEMBL27675225 | 0.70 | CYP1A2 (0.59) | ALDH1A1NPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL12826413 | 0.67 | TSHR (0.54) | ALDH1A1MAPTGAANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008091594-A2 | FUNGICIDAL MIXTURES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2008-07-31 | — | — | WO | disclosed |