Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 17/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.50 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.50 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL9524883 | 0.81 | CYP19A1 (0.47) | CYP19A1CYP3A4CYP2D6CYP26A1CYP2C8 | |
| Oxalic Acid SCHEMBL9524892 | 0.81 | CYP19A1 (0.47) | CYP19A1CYP3A4CYP2D6CYP26A1CYP2C8 | |
| SCHEMBL9524756 | 0.79 | CYP19A1 (0.60) | CYP19A1CYP3A4CYP2D6CYP26A1CYP2C8 | |
| SCHEMBL9525292 | 0.73 | CYP17A1 (0.44) | CYP19A1CYP26A1CYP17A1 | |
| SCHEMBL9525487 | 0.73 | CYP19A1 (0.59) | CYP19A1CYP3A4CYP26A1CYP17A1MEN1 | |
| SCHEMBL10459653 | 0.72 | CYP17A1 (0.41) | CYP19A1CYP26A1CYP17A1 | |
| SCHEMBL9525930 | 0.72 | MGAM (0.38) | ALDH1A1HPGDKMT2ANPSR1 | |
| SCHEMBL9523312 | 0.71 | CYP19A1 (0.65) | CYP19A1CYP3A4CYP2D6CYP26A1CYP2C8 | |
| Oxalic Acid SCHEMBL9868434 | 0.70 | CYP19A1 (0.48) | CYP19A1CYP3A4CYP26A1CYP17A1MEN1 | |
| Oxalic Acid SCHEMBL27268074 | 0.70 | CYP19A1 (0.48) | CYP19A1CYP3A4CYP26A1CYP17A1MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0293978-B1 | (1H-AZOL-1-YLMETHYL)SUBSTITUTED BENZOTRIAZOLE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-09-15 | — | — | EP | disclosed |
| US-5039677-A | Estrogen inhibitor | JANSSEN PHARMACEUTICA N.V. (CA) | 1991-08-13 | — | — | US | disclosed |
| US-4943574-A | AROMATASE INHIBITORS, ESTROGEN DISORDERS | JANSSEN PHARMACEUTICA N.V. (BE) | 1990-07-24 | — | — | US | disclosed |
| EP-0293978-A2 | (1H-azol-1-ylmethyl)substituted benzotriazole derivatives | JANSSEN PHARMACEUTICA N.V. (BE) | 1988-12-07 | — | — | EP | disclosed |