Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | KIF11 | P52732 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10342527 | 0.71 | KIF11 (0.41) | CES1KIF11 | |
| Methoxytriphenylmethane SCHEMBL9103 | 0.71 | MAPK1 (0.48) | KCNN4CES1MAPK1CYP19A1KIF11 | |
| SCHEMBL207056 | 0.70 | ACHE (0.30) | — | |
| Methoxytriphenylmethane SCHEMBL27882817 | 0.69 | MAPK1 (0.46) | KCNN4CES1MAPK1CYP19A1KIF11 | |
| SCHEMBL262756 | 0.68 | NT5E (0.30) | — | |
| SCHEMBL18705868 | 0.67 | — | — | |
| SCHEMBL8165391 | 0.67 | CA4 (0.38) | CES1KIF11 | |
| SCHEMBL6987196 | 0.66 | — | — | |
| SCHEMBL13645096 | 0.66 | ESR1 (0.39) | KCNN4CES1MAPK1CYP19A1KIF11 | |
| SCHEMBL11091542 | 0.65 | CYP19A1 (0.37) | KCNN4CES1MAPK1CYP19A1KIF11 |
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-5665774-A | TREATMENT OF AUTOIMMUNE DISEASES | VERTEX PHARMACEUTICALS INCORPORATED | 1997-09-09 | — | — | US | disclosed |