Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 4/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 5/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | P4HA1 | P13674 | 1/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL63616 | 0.97 | HDAC3 (0.54) | HDAC3HDAC2CHEK1CYP1A2CYP2C18 | |
| SCHEMBL28314039 | 0.95 | HDAC3 (0.53) | HDAC3HDAC2CHEK1CYP1A2CYP2C18 | |
| SCHEMBL22159239 | 0.84 | HDAC3 (0.51) | HDAC3HDAC2CHEK1CYP1A2CYP2C18 | |
| SCHEMBL1173393 | 0.82 | MAPT (0.49) | NPC1RAB9ALMNATP53SMN1; SMN2 | |
| SCHEMBL1912372 | 0.82 | GFER (0.54) | NPC1RAB9AMAPTMEN1GAA | |
| Lithium Ion SCHEMBL20163088 | 0.82 | HDAC3 (0.49) | HDAC3HDAC2CHEK1CYP1A2CYP2C18 | |
| SCHEMBL23594170 | 0.82 | CACNA2D1 (0.47) | HDAC3HDAC2CHEK1CYP1A2CYP2C18 | |
| SCHEMBL30230133 | 0.81 | AKR1C3 (0.46) | HDAC3HDAC2SMN1; SMN2MAPTP4HA1 | |
| SCHEMBL20207616 | 0.81 | HDAC3 (0.46) | HDAC3HDAC2CYP1A2CYP2C18CYP2C19 | |
| SCHEMBL3342623 | 0.81 | MAPT (0.51) | CYP1A2CYP2C19NPC1RAB9ALMNA |
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-111925357-B | Acylhydrazone compound, pharmaceutical composition and application thereof | 中国科学院昆明植物研究所 | 2023-06-06 | — | — | CN | disclosed |