Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | DHODH | Q02127 | 2/20 | 0.42 |
| ▸ | CDC25B | P30305 | 2/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CASP3 | P42574 | 2/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28537077 | 0.90 | SMN1; SMN2 (0.50) | NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL28543850 | 0.83 | SLC26A6 (0.46) | CYP1A2NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL28532069 | 0.81 | ALDH1A1 (0.54) | CYP1A2NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL28532052 | 0.80 | HTT (0.56) | CYP1A2NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL28545378 | 0.79 | SMN1; SMN2 (0.48) | NPC1RAB9ASMN1; SMN2DHODHTP53 | |
| SCHEMBL28543158 | 0.78 | SMN1; SMN2 (0.53) | CYP1A2NPC1RAB9ASMN1; SMN2DHODH | |
| SCHEMBL28545895 | 0.78 | MAPT (0.46) | CYP1A2RAB9ASMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL29031128 | 0.77 | SMN1; SMN2 (0.47) | CYP1A2NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL29031101 | 0.77 | SMN1; SMN2 (0.52) | CYP1A2NPC1RAB9ASMN1; SMN2CDC25B | |
| SCHEMBL347328 | 0.74 | CYP1A2 (0.51) | CYP1A2NPC1RAB9ASMN1; SMN2ALDH1A1 |
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-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 |
| CN-111925357-A | Acylhydrazone compound, pharmaceutical composition and application thereof | 中国科学院昆明植物研究所 | 2020-11-13 | — | — | CN | disclosed |