Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | HPGD | P15428 | 4/20 | 0.54 |
| ▸ | GAA | P10253 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | GRM6 | O15303 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27636759 | 0.83 | ALDH1A1 (0.55) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL27556717 | 0.82 | ALDH1A1 (0.49) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL18803865 | 0.80 | ALDH1A1 (0.59) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL5720759 | 0.80 | ESR2 (0.44) | SMN1; SMN2MEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11053115 | 0.79 | CA12 (0.57) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL2200758 | 0.78 | TSHR (0.56) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL30488962 | 0.78 | TSHR (0.56) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL28998463 | 0.78 | ALDH1A1 (0.54) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL3135452 | 0.77 | BCAT2 (0.47) | ALDH1A1HPGDGAAKDM4EMAPT | |
| SCHEMBL23689805 | 0.76 | TSHR (0.62) | ALDH1A1HPGDGAAKDM4EMAPT |
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-4486588-A | Cyclohexadiene carboxylate insecticide intermediates | FMC CORPORATION (US) | 1984-12-04 | — | — | US | disclosed |