Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MAP3K8 | P41279 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31453612 | 0.86 | MAPK1 (0.56) | HRH3CHRNA7KCNH2BACE1MAPK1 | |
| SCHEMBL5929424 | 0.84 | HRH3 (0.46) | HRH3CHRNA7KCNH2BACE1MAPK1 | |
| Hydrochloric Acid SCHEMBL5929367 | 0.83 | HRH3 (0.45) | HRH3CHRNA7KCNH2BACE1MAPK1 | |
| SCHEMBL6840686 | 0.79 | HRH3 (0.46) | HRH3BACE1ALDH1A1EGFR | |
| SCHEMBL5929350 | 0.79 | KDM4E (0.51) | HRH3ALDH1A1RAB9AL3MBTL1POLB | |
| SCHEMBL18570641 | 0.78 | HTR7 (0.44) | CYP3A4HRH3BACE1MAPK1ALDH1A1 | |
| SCHEMBL5929421 | 0.75 | ADRA2A (0.43) | CYP3A4CYP2C19HRH3ALDH1A1 | |
| SCHEMBL31453546 | 0.74 | ALDH1A1 (0.49) | CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL5929366 | 0.74 | SRC (0.45) | ALDH1A1RAB9AHTR7 | |
| SCHEMBL6142477 | 0.73 | ACHE (0.45) | CYP3A4HRH3ALDH1A1 |
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-2025016138-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | SUZHOU EOC MEDICAL RESEARCH CO., LTD. (CN) | 2025-01-23 | — | — | WO | disclosed |