Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | VNN1 | O95497 | 2/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CCR6 | P51684 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6474489 | 0.85 | CYP19A1 (0.44) | CYP19A1KIF11MAOBVNN1DAO | |
| SCHEMBL6526163 | 0.77 | CYP19A1 (0.41) | CYP19A1MAOBALDH1A1 | |
| SCHEMBL6527102 | 0.75 | TRPA1 (0.40) | CYP19A1MAOBPTGDR2KDM1AALDH1A1 | |
| SCHEMBL2350966 | 0.74 | CYP19A1 (0.43) | CYP19A1KIF11MAOBCYP3A4CYP3A5 | |
| SCHEMBL9159563 | 0.70 | KIF11 (0.47) | CYP19A1KIF11MAOBVNN1PTGDR2 | |
| SCHEMBL9192710 | 0.66 | CYP19A1 (0.45) | CYP19A1VNN1PTGDR2 | |
| SCHEMBL6573450 | 0.65 | CYP19A1 (0.41) | CYP19A1MAOBVNN1PTGDR2 | |
| SCHEMBL11092221 | 0.64 | GABBR2 (0.34) | CYP19A1CYP3A4KMT2A | |
| SCHEMBL9093244 | 0.64 | CYP19A1 (0.61) | CYP19A1KIF11MAOBVNN1PTGDR2 | |
| SCHEMBL5925435 | 0.64 | KIF11 (0.43) | CYP19A1KIF11MAOBVNN1PTGDR2 |
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-1534265-A1 | COMBINATION OF AN AROMATASE INHIBITOR WITH A BISPHOSPHONATE | Novartis AG (CH) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004012728-A1 | COMBINATION OF AN AROMATASE INHIBITOR WITH A BISPHOSPHONATE | NOVARTIS AG (CH) | 2004-02-12 | — | — | WO | disclosed |