Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 5/20 | 1.00 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL9836190 | 0.90 | TBXAS1 (0.82) | TBXAS1CYP19A1CYP17A1MEN1NR1I2 | |
| SCHEMBL9834671 | 0.89 | TBXAS1 (0.80) | TBXAS1CYP19A1CYP17A1MEN1NR1I2 | |
| SCHEMBL9836582 | 0.85 | TBXAS1 (0.74) | TBXAS1CYP19A1CYP17A1MEN1NR1I2 | |
| SCHEMBL9835146 | 0.83 | TBXAS1 (0.71) | TBXAS1CYP19A1CYP17A1MEN1NR1I2 | |
| SCHEMBL27264305 | 0.83 | TBXAS1 (0.71) | TBXAS1CYP19A1CYP17A1 | |
| Formic Acid SCHEMBL27264309 | 0.80 | TBXAS1 (0.67) | TBXAS1CYP19A1CYP17A1MEN1NR1I2 | |
| SCHEMBL9836789 | 0.80 | TBXAS1 (0.67) | TBXAS1CYP17A1CYP3A4CYP26A1 | |
| SCHEMBL9835558 | 0.78 | TBXAS1 (0.63) | TBXAS1CYP19A1CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL10553258 | 0.76 | TBXAS1 (0.61) | TBXAS1CYP19A1CYP17A1MEN1NR1I2 | |
| Water SCHEMBL9837182 | 0.75 | TBXAS1 (0.60) | TBXAS1CYP19A1CYP17A1MEN1NR1I2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0240107-B1 | THIANAPHTHENE DERIVATIVES, THEIR PRODUCTION AND USE | Sankyo Company Limited (JP) | 1991-08-21 | — | — | EP | claimed |
| US-4847272-A | ANTICOAGULANTS | SANKYO COMPANY LIMITED (JP) | 1989-07-11 | — | — | US | claimed |
| EP-0240107-A1 | Thianaphthene derivatives, their production and use | Sankyo Company Limited (JP) | 1987-10-07 | — | — | EP | claimed |