Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.59 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.56 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL30616069 | 1.00 | CYP19A1 (0.73) | CYP19A1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL13957035 | 0.91 | CYP19A1 (0.86) | CYP19A1CYP1A2CYP2C19P2RX4HDAC6 | |
| SCHEMBL30007452 | 0.85 | CYP19A1 (1.00) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL151053 | 0.85 | CYP19A1 (1.00) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL17841725 | 0.83 | CYP19A1 (0.73) | CYP19A1CYP1A2CYP2C19P2RX4HDAC6 | |
| Ammonia Solution, Strong SCHEMBL29210102 | 0.83 | CYP19A1 (0.95) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| Bromide SCHEMBL28888744 | 0.83 | CYP19A1 (0.95) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9398256 | 0.83 | CYP19A1 (0.95) | CYP19A1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28969544 | 0.82 | HDAC3 (0.59) | CYP19A1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18382517 | 0.82 | CYP19A1 (0.70) | CYP19A1ALDH1A1CYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118290336-A | Environment-friendly method for implementing debenzylation of amine compound by catalyzing molecular oxygen oxidation through semiconductor photocatalyst | 大连理工大学 | 2024-07-05 | — | — | CN | disclosed |
| CN-116874409-A | Green debenzylation method by photocatalytic molecular oxygen oxidation | 大连理工大学 | 2023-10-13 | — | — | CN | disclosed |