Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ATR | Q13535 | 3/20 | 0.47 |
| ▸ | PRKDC | P78527 | 2/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.45 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | BCL2 | P10415 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL24993576 | 0.88 | NPC1 (0.50) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL24993559 | 0.86 | ALDH1A1 (0.53) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL24993563 | 0.84 | MAPT (0.51) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL24993561 | 0.81 | ALDH1A1 (0.55) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL24993560 | 0.80 | ALDH1A1 (0.54) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL24994394 | 0.80 | RAB9A (0.52) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL24994337 | 0.74 | NPC1 (0.52) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL24993550 | 0.74 | NPC1 (0.52) | ALDH1A1MAPTNPC1KDM4EATR | |
| SCHEMBL3461301 | 0.73 | ATR (0.57) | ATRPRKDC | |
| SCHEMBL24993306 | 0.72 | SCN10A (0.69) | ALDH1A1MAPTNPC1KDM4ESCN2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023010191-A1 | N-ACYLHYDRAZONE COMPOUNDS CAPABLE OF INHIBITING NAV1.7 AND/OR NAV1.8, PROCESSES FOR THE PREPARATION THEREOF, COMPOSITIONS, USES, METHODS FOR TREATMENT USING SAME, AND KITS | EUROFARMA LABORATÓRIOS S.A. (BR) | 2023-02-09 | — | — | WO | disclosed |