Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 11/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | 0.90 | CYP19A1 (0.44) | CYP19A1ESR1ESR2MAOB | |
| SCHEMBL6527102 | 0.88 | TRPA1 (0.40) | CYP19A1ALDH1A1MAOB | |
| SCHEMBL30525997 | 0.81 | ESR1 (0.52) | CYP19A1ESR1ESR2LOXL2CYP2A6 | |
| SCHEMBL6522652 | 0.77 | CYP19A1 (0.42) | CYP19A1ALDH1A1MAOB | |
| SCHEMBL690958 | 0.77 | HRH3 (0.54) | CYP19A1HRH3LOXL2CYP2A6KDM4E | |
| SCHEMBL19877208 | 0.75 | KCNJ1 (0.42) | CYP19A1HRH3LOXL2CYP2A6KDM4E | |
| Hydrochloric Acid SCHEMBL690028 | 0.75 | HRH3 (0.53) | CYP19A1HRH3LOXL2CYP2A6KDM4E | |
| SCHEMBL28833064 | 0.73 | HRH3 (0.50) | CYP19A1HRH3LOXL2CYP2A6KDM4E | |
| SCHEMBL9167292 | 0.72 | CYP19A1 (0.44) | CYP19A1HPGDMAOB | |
| SCHEMBL9167053 | 0.72 | CYP19A1 (0.46) | CYP19A1ESR1ESR2ALDH1A1CYP1A2 |
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 |