Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CCR1 | P32246 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 1/20 | 0.38 |
| ▸ | CCR8 | P51685 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.38 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29608023 | 1.00 | EPHX2 (0.45) | EPHX2NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL4190714 | 0.81 | KDM4E (0.50) | NPC1ALDH1A1CYP2D6CYP2C19KDM4E | |
| SCHEMBL10202933 | 0.81 | TSHR (0.44) | NPC1ALDH1A1CYP2D6CYP2C19MCHR1 | |
| SCHEMBL1690260 | 0.80 | L3MBTL1 (0.46) | EPHX2NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL31143619 | 0.80 | L3MBTL1 (0.46) | EPHX2NPC1ALDH1A1CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL5573938 | 0.78 | L3MBTL1 (0.45) | EPHX2NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL28292590 | 0.78 | TSHR (0.46) | NPC1ALDH1A1CYP2D6CYP2C19MCHR1 | |
| SCHEMBL15617823 | 0.78 | NPC1 (0.43) | NPC1ALDH1A1CYP2D6CYP2C19KDM4E | |
| SCHEMBL29969403 | 0.78 | HTR1A (0.45) | EPHX2NPC1ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL13310631 | 0.76 | TSHR (0.43) | NPC1ALDH1A1CYP2D6CYP2C19KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-4149465-A1 | SUBSTITUTED PYRIDAZINONE FOR USE IN THE TREATMENT OF NEUROMUSCULAR DISEASES | EDGEWISE THERAPEUTICS, INC. (US) | 2023-03-22 | — | — | EP | disclosed |
| CN-104812755-A | Pyrazolopyridine derivatives as TTX-S blockers | RAQUALIA PHARMA INC | 2015-07-29 | — | — | CN | disclosed |