Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28881522 | 0.89 | MAOB (0.31) | TAAR1ALDH1A1POLBMAOB | |
| SCHEMBL15952484 | 0.82 | ESR1 (0.40) | TAAR1HRH3KDM4ELMNA | |
| SCHEMBL28906287 | 0.76 | SMN1; SMN2 (0.35) | TAAR1ALDH1A1POLBSMN1; SMN2PPARA | |
| SCHEMBL28906297 | 0.75 | DAO (0.34) | TAAR1ALDH1A1POLBSMN1; SMN2PPARA | |
| SCHEMBL24602755 | 0.73 | CYP1A2 (0.52) | TAAR1ALDH1A1SMN1; SMN2HRH3 | |
| SCHEMBL17722492 | 0.73 | LPL (0.46) | ALDH1A1 | |
| SCHEMBL20536283 | 0.72 | PPARA (0.35) | TAAR1ALDH1A1POLBCALM1PPARA | |
| SCHEMBL3211356 | 0.71 | GFER (0.59) | TAAR1ALDH1A1MAOBSMN1; SMN2 | |
| SCHEMBL21925685 | 0.71 | CA2 (0.41) | PPARA | |
| SCHEMBL20004512 | 0.71 | TAAR1 (0.50) | TAAR1POLBSMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-110678450-B | Isoxazole derivatives as nuclear receptor agonists and uses thereof | 日东制药株式会社 | 2023-06-20 | — | — | CN | disclosed |
| CN-110678450-A | Isoxazole derivatives as nuclear receptor agonists and uses thereof | 日东制药株式会社 | 2020-01-10 | — | — | CN | disclosed |