Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | CCNK | O75909 | 1/20 | 0.40 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.40 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.40 |
| ▸ | PNP | P00491 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20508793 | 1.00 | HRH4 (0.46) | HRH4HRH3MMP2CCNKCDK12 | |
| Hydrochloric Acid SCHEMBL30297964 | 0.99 | HRH4 (0.44) | HRH4HRH3MMP2CCNKCDK12 | |
| SCHEMBL28110985 | 0.84 | CYP1A2 (0.48) | HRH4HRH3CYP1A2CYP2D6JAK2 | |
| SCHEMBL30297934 | 0.83 | HTR6 (0.40) | HRH4HRH3PNPCYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL30297929 | 0.82 | HTR6 (0.39) | HRH4HRH3PNPCYP1A2CYP2D6 | |
| SCHEMBL30298028 | 0.76 | NUDT1 (0.44) | NUDT1CYP1A2JAK2JAK1TYK2 | |
| Hydrochloric Acid SCHEMBL30297975 | 0.75 | NUDT1 (0.43) | NUDT1CYP1A2JAK2JAK1TYK2 | |
| SCHEMBL29715845 | 0.74 | APP (0.41) | CYP2D6JAK2ADORA2AADORA1 | |
| SCHEMBL20508792 | 0.74 | L3MBTL1 (0.41) | HRH4HRH3NUDT1PNPJAK2 | |
| SCHEMBL20508822 | 0.74 | PDE8B (0.39) | HRH4PNPADORA2AADORA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4398986-A1 | METHODS FOR TREATING NEUROGENERATIVE DISEASES | PTC Therapeutics, Inc. (US) | 2024-07-17 | — | — | EP | claimed |
| WO-2023039368-A1 | METHODS FOR TREATING NEUROGENERATIVE DISEASES | PTC THERAPEUTICS, INC. (US) | 2023-03-16 | — | — | WO | claimed |