Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHIT1 | Q13231 | 18/20 | 0.70 |
| ▸ | KCNH2 | Q12809 | 11/20 | 0.70 |
| ▸ | CHIA | Q9BZP6 | 8/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL22901759 | 1.00 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| SCHEMBL21565739 | 0.93 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| SCHEMBL18577444 | 0.93 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| SCHEMBL22901833 | 0.93 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| SCHEMBL18607764 | 0.93 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| Trifluoroacetic Acid SCHEMBL28708518 | 0.92 | CHIT1 (0.60) | CHIT1KCNH2CHIA | |
| SCHEMBL18609574 | 0.87 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| SCHEMBL18577285 | 0.87 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| SCHEMBL18609866 | 0.87 | CHIT1 (0.70) | CHIT1KCNH2CHIA | |
| SCHEMBL18609991 | 0.87 | CHIT1 (0.70) | CHIT1KCNH2CHIA |
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-2021009209-A1 | SUBSTITUTED AMINO TRIAZOLES USEFUL AS CHITINASE INHIBITORS | Oncoarendi Therapeutics S.A. (PL) | 2021-01-21 | — | — | WO | disclosed |