Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.57 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.57 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.57 |
| ▸ | HDAC7 | Q8WUI4 | 6/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.57 |
| ▸ | HDAC10 | Q969S8 | 6/20 | 0.57 |
| ▸ | HDAC11 | Q96DB2 | 6/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.57 |
| ▸ | HDAC9 | Q9UKV0 | 6/20 | 0.57 |
| ▸ | HDAC5 | Q9UQL6 | 6/20 | 0.57 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | NQO2 | P16083 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1813320 | 0.82 | RAB9A (0.60) | HDAC6HDAC2HDAC8NQO2MTNR1A | |
| SCHEMBL13202035 | 0.81 | HDAC2 (0.65) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL27698094 | 0.79 | NPC1 (0.64) | CYP1A2CYP2D6CYP2C19TRPV1GAA | |
| SCHEMBL8486831 | 0.79 | NPC1 (0.66) | TRPV1POLBGAA | |
| SCHEMBL7866515 | 0.79 | MEN1 (0.73) | CYP2C19L3MBTL1TRPV1POLB | |
| SCHEMBL662029 | 0.79 | DEGS1 (0.65) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL1193527 | 0.79 | HDAC1 (0.66) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL6292910 | 0.79 | HDAC1 (0.66) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL6360257 | 0.77 | HDAC3 (0.72) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL7866111 | 0.77 | HDAC3 (0.64) | HDAC1HDAC6HDAC3HDAC4HDAC7 |
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-112194629-B | Phenethyl azole derivative and preparation method and application thereof | 聊城大学 | 2023-10-24 | — | — | CN | disclosed |