Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 16/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | FNTA | P49354 | 1/20 | 0.45 |
| ▸ | FNTB | P49356 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1507798 | 0.80 | CYP19A1 (0.85) | CYP19A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10693298 | 0.80 | CYP19A1 (1.00) | CYP19A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3499887 | 0.77 | FNTA (0.59) | CYP19A1CYP1A2CYP3A4CYP2D6FNTA | |
| SCHEMBL11366789 | 0.74 | CYP19A1 (1.00) | CYP19A1CYP1A2CYP3A4CYP2D6FNTA | |
| SCHEMBL8917184 | 0.73 | CYP19A1 (0.84) | CYP19A1CYP1A2CYP3A4CYP2D6 | |
| Trifluoroacetic Acid SCHEMBL7980448 | 0.73 | FNTA (0.51) | CYP19A1FNTAFNTB | |
| SCHEMBL1507825 | 0.72 | CYP19A1 (1.00) | CYP19A1CYP3A4 | |
| SCHEMBL11479567 | 0.71 | CYP19A1 (0.68) | CYP19A1CYP1A2CYP3A4CYP2D6FNTA | |
| SCHEMBL11463766 | 0.71 | CYP19A1 (0.68) | CYP19A1CYP1A2CYP3A4CYP2D6FNTA | |
| SCHEMBL11353276 | 0.71 | CYP19A1 (0.91) | CYP19A1CYP1A2CYP3A4CYP2D6FNTA |
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-6297239-B1 | Inhibitors of prenyl-protein transferase | MERCK & CO., INC. | 2001-10-02 | — | — | US | disclosed |