Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.62 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30616064 | 1.00 | CYP19A1 (0.62) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL30616065 | 0.85 | CYP19A1 (0.63) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL29093125 | 0.85 | CYP19A1 (0.63) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL30574436 | 0.82 | CYP19A1 (0.70) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL22385834 | 0.82 | CYP19A1 (0.70) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL13957035 | 0.79 | CYP19A1 (0.86) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL2801622 | 0.79 | FABP4 (0.46) | CYP19A1HDAC6HDAC1CYP1A2CYP2C19 | |
| SCHEMBL2246814 | 0.79 | CYP19A1 (0.70) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL29037474 | 0.79 | CYP19A1 (0.70) | CYP19A1P2RX4HDAC6HDAC1HDAC10 | |
| SCHEMBL9128630 | 0.78 | CYP19A1 (0.76) | CYP19A1P2RX4HDAC6HDAC1HDAC10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116874409-A | Green debenzylation method by photocatalytic molecular oxygen oxidation | 大连理工大学 | 2023-10-13 | — | — | CN | disclosed |