Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 11/20 | 0.60 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.57 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.47 |
| ▸ | QPCT | Q16769 | 1/20 | 0.47 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.47 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL11767231 | 0.81 | CYP19A1 (0.55) | CYP19A1CYP17A1CYP24A1TBXA2R | |
| SCHEMBL27862767 | 0.79 | CYP19A1 (0.60) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| SCHEMBL27581291 | 0.79 | CYP19A1 (0.60) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL9996088 | 0.78 | CYP19A1 (0.59) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| Hydrochloric Acid SCHEMBL28794239 | 0.78 | CYP19A1 (0.59) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| SCHEMBL5326129 | 0.78 | CYP19A1 (0.59) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| SCHEMBL29283779 | 0.77 | CYP19A1 (0.70) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| SCHEMBL29283780 | 0.77 | CYP19A1 (0.70) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| SCHEMBL27905027 | 0.77 | CYP19A1 (0.57) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT | |
| SCHEMBL5814714 | 0.77 | CYP19A1 (0.57) | CYP19A1CYP17A1CYP24A1CYP3A4MAPT |
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-1276725-A2 | 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE | WARNER-LAMBERT COMPANY (US) | 2003-01-22 | — | — | EP | disclosed |
| WO-2001079180-A2 | 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE | WARNER-LAMBERT COMPANY (US) | 2001-10-25 | — | — | WO | disclosed |