Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.45 |
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PDE5A | O76074 | 2/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29619095 | 1.00 | MEN1 (0.46) | MEN1KMT2ATSHRTDP1PTGDR2 | |
| SCHEMBL16619017 | 0.84 | AKR1C3 (0.47) | MEN1KMT2ATDP1PTGDR2AKR1C3 | |
| SCHEMBL1903461 | 0.83 | TDP1 (0.48) | TDP1AKR1C3BRD4ALDH1A1CYP19A1 | |
| SCHEMBL29619010 | 0.83 | MAPT (0.46) | MEN1KMT2ATDP1AKR1C3BRD4 | |
| SCHEMBL29619121 | 0.82 | ALDH1A1 (0.43) | MEN1KMT2AAKR1C3BRD4ALDH1A1 | |
| SCHEMBL17467704 | 0.82 | AKR1C3 (0.41) | MEN1KMT2ATSHRTDP1AKR1C3 | |
| SCHEMBL29619013 | 0.81 | BRD4 (0.48) | KMT2ABRD4CREBBPALDH1A1MAPT | |
| SCHEMBL29619075 | 0.80 | BRD4 (0.45) | PTGDR2BRD4CREBBP | |
| SCHEMBL16618869 | 0.78 | TDP1 (0.48) | MEN1KMT2ATSHRTDP1AKR1C3 | |
| SCHEMBL11980663 | 0.78 | ALDH1A1 (0.49) | MEN1KMT2ATSHRTDP1BRD4 |
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-2022093850-A1 | ISOXAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARMACEUTICALS, INC. (US) | 2022-05-05 | — | — | WO | disclosed |