Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
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 SCHEMBL1628375 | 0.97 | ALDH1A1 (0.36) | ALDH1A1L3MBTL1THRBCA2TSHR | |
| Trifluoroacetic Acid SCHEMBL30699576 | 0.93 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1THRBCA2TSHR | |
| Trifluoroacetic Acid SCHEMBL27753577 | 0.93 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1THRBCA2TSHR | |
| Trifluoroacetic Acid SCHEMBL5583768 | 0.90 | ALDH1A1 (0.33) | ALDH1A1L3MBTL1THRBCA2TSHR | |
| Trifluoroacetic Acid SCHEMBL10797973 | 0.86 | — | — | |
| Trifluoroacetic Acid SCHEMBL10426731 | 0.82 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1THRBCA2TSHR | |
| Trifluoroacetic Acid SCHEMBL7814389 | 0.82 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1THRBCA2TSHR | |
| Trifluoroacetic Acid SCHEMBL30657022 | 0.82 | — | — | |
| Trifluoroacetic Acid SCHEMBL4598430 | 0.82 | — | — | |
| Trifluoroacetic Acid SCHEMBL2484766 | 0.82 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1THRBCA2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4464299-A | Antibacterial carbapenem compounds | SHIONOGI & CO., LTD. (JP) | 1984-08-07 | — | — | US | disclosed |