Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHIT1 | Q13231 | 16/20 | 0.54 |
| ▸ | CHIA | Q9BZP6 | 15/20 | 0.54 |
| ▸ | CHI3L1 | P36222 | 8/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.54 |
| ▸ | CHI3L2 | Q15782 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22901938 | 1.00 | CHIT1 (0.54) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| SCHEMBL22901882 | 1.00 | CHIT1 (0.54) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| SCHEMBL22903498 | 1.00 | CHIT1 (0.54) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| Trifluoroacetic Acid SCHEMBL28699995 | 0.92 | KCNH2 (0.51) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| Trifluoroacetic Acid SCHEMBL28699994 | 0.92 | KCNH2 (0.51) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| SCHEMBL26219888 | 0.91 | CHIA (0.63) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| SCHEMBL26211089 | 0.91 | CHIA (0.63) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| SCHEMBL22901943 | 0.90 | CHIT1 (0.44) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| Hydrochloric Acid SCHEMBL25385159 | 0.90 | CHIA (0.62) | CHIT1CHIACHI3L1KCNH2CHI3L2 | |
| SCHEMBL18608039 | 0.84 | CHIA (0.64) | CHIT1CHIACHI3L1KCNH2CHI3L2 |
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 |