Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | HTT | P42858 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | GSK3A | P49840 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6679218 | 0.90 | MAPK1 (0.64) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6689634 | 0.86 | MAPK1 (0.63) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6678045 | 0.84 | MAPT (0.55) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6683009 | 0.83 | MAPK1 (0.52) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6687187 | 0.83 | ALDH1A1 (0.67) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6688949 | 0.80 | MAPK1 (0.49) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6689377 | 0.80 | MAPT (0.50) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6684426 | 0.80 | MAPT (0.50) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6691516 | 0.79 | MAPK1 (0.53) | NPC1RAB9AMAPK1ALDH1A1HTT | |
| SCHEMBL6686093 | 0.79 | MAPK1 (0.52) | NPC1RAB9AMAPK1ALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004043951-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | CAREX S.A. (FR) | 2004-05-27 | — | — | WO | claimed |
| WO-2004043951-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | CAREX S.A. (FR) | 2004-05-27 | — | — | WO | disclosed |