Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.70 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.58 |
| ▸ | P2RX4 | Q99571 | 4/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | GALR3 | O60755 | 1/20 | 0.54 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL22385834 | 1.00 | CYP19A1 (0.70) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL13957035 | 0.89 | CYP19A1 (0.86) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL2246814 | 0.84 | CYP19A1 (0.70) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL29037474 | 0.84 | CYP19A1 (0.70) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL30007452 | 0.83 | CYP19A1 (1.00) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL151053 | 0.83 | CYP19A1 (1.00) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL29092935 | 0.82 | CYP19A1 (0.62) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL30616064 | 0.82 | CYP19A1 (0.62) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL8173916 | 0.82 | CYP19A1 (0.57) | CYP19A1HDAC6HDAC1HDAC10P2RX4 | |
| SCHEMBL4780793 | 0.82 | PTGER4 (0.55) | CYP19A1HDAC6HDAC1HDAC10P2RX4 |
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-116724685-A | Organic electroluminescent device and organic compound for organic electroluminescent device | 株式会社乐普拓 | 2023-09-08 | — | — | CN | disclosed |