Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1610079 | 0.87 | TSHR (0.51) | TSHRNOTUMALDH1A1GAAHPGD | |
| SCHEMBL14736589 | 0.82 | PDE10A (0.56) | TSHRNOTUMALDH1A1GAAHPGD | |
| SCHEMBL3616245 | 0.80 | NOTUM (0.58) | TSHRNOTUMALDH1A1GAACYP1A2 | |
| SCHEMBL1609985 | 0.78 | NOTUM (0.55) | TSHRNOTUMALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL15471161 | 0.77 | RAB9A (0.63) | TSHRNOTUMALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL14833395 | 0.77 | CYP1A2 (0.68) | TSHRNOTUMALDH1A1GAAHPGD | |
| SCHEMBL14736868 | 0.75 | NOTUM (0.58) | TSHRNOTUMALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL27609469 | 0.75 | NOTUM (0.58) | TSHRNOTUMALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL10312555 | 0.75 | TSHR (0.56) | TSHRALDH1A1HPGDLMNA | |
| SCHEMBL14736015 | 0.74 | PDE10A (0.52) | TSHRNOTUMALDH1A1GAAHPGD |
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-1476438-A1 | OXA- AND THIADIAZOLES AND THEIR USE AS METALLOPROTEINASE INHIBITORS | Vernalis (Oxford) Ltd (GB) | 2004-11-17 | — | — | EP | disclosed |
| WO-2003070711-A1 | OXA- AND THIADIAZOLES AND THEIR USE AS METALLOPROTEINASE INHIBITORS | VERNALIS (OXFORD) LTD (GB) | 2003-08-28 | — | — | WO | disclosed |