Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.41 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.41 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL23830859 | 0.88 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL23830909 | 0.87 | PARP10 (0.55) | — | |
| Trifluoroacetic Acid SCHEMBL27137357 | 0.86 | — | — | |
| Trifluoroacetic Acid SCHEMBL23830840 | 0.86 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL21590734 | 0.83 | — | — | |
| SCHEMBL2582519 | 0.83 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL23830498 | 0.82 | EPHX2 (0.46) | — | |
| Trifluoroacetic Acid SCHEMBL23830800 | 0.81 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL23830644 | 0.80 | SLC6A4 (0.48) | SLC6A2SLC6A4SLC6A3 | |
| Trifluoroacetic Acid SCHEMBL23831006 | 0.80 | GRIN1 (0.43) | — |
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-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |