Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18909472 | 0.81 | — | — | |
| Trifluoroacetic Acid SCHEMBL19259630 | 0.73 | HRH4 (0.37) | KDM1A | |
| SCHEMBL20123920 | 0.73 | — | — | |
| SCHEMBL23892031 | 0.71 | SLC6A4 (0.37) | KDM1A | |
| SCHEMBL25317589 | 0.70 | KDM1A (0.37) | KDM1AKCNH2 | |
| SCHEMBL24675499 | 0.69 | HSD17B10 (0.44) | KDM1AKCNH2 | |
| Trifluoroacetic Acid SCHEMBL2379719 | 0.69 | DPP4 (0.32) | — | |
| SCHEMBL25468661 | 0.68 | — | — | |
| Trifluoroacetic Acid SCHEMBL27647070 | 0.68 | MCL1 (0.32) | — | |
| SCHEMBL23894814 | 0.68 | DPP4 (0.35) | KDM1AKCNH2HSD11B1 |
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-2023139085-A1 | NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2023-07-27 | — | — | WO | disclosed |