Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 10/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19547077 | 0.85 | HRH3 (0.41) | HRH3DRD2KCNH2 | |
| SCHEMBL23916367 | 0.84 | HRH4 (0.36) | HTR6HRH4HRH3KDM2BACHE | |
| SCHEMBL19547055 | 0.80 | GBA1 (0.39) | HRH4HRH3KCNH2 | |
| SCHEMBL19546768 | 0.75 | HRH4 (0.38) | HRH4KDM2B | |
| SCHEMBL611477 | 0.74 | NR1D2 (0.45) | ACHEKCNH2 | |
| SCHEMBL610391 | 0.73 | CCR3 (0.41) | HRH4HRH3ACHEKCNH2 | |
| SCHEMBL8302404 | 0.73 | KDM4E (0.50) | HTR6HRH4HRH3ACHECYP2C19 | |
| SCHEMBL19546938 | 0.72 | WNT1 (0.39) | HRH4HRH3KDM2B | |
| SCHEMBL19546613 | 0.71 | POLB (0.42) | HRH4 | |
| SCHEMBL16293110 | 0.71 | KDM2B (0.38) | KDM2B |
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-3892276-A1 | ISOQUINOLIN-3-YL CARBOXAMIDES AS WNT INHIBITORS | BioSplice Therapeutics, Inc. (US) | 2021-10-13 | — | — | EP | disclosed |
| WO-2017189829-A1 | ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF | SAMUMED, LLC (US) | 2017-11-02 | — | — | WO | disclosed |