Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 5/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.48 |
| ▸ | FABP3 | P05413 | 5/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| Tetrylammonium SCHEMBL5875094 | 0.97 | BBOX1 (0.58) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Adipic Acid SCHEMBL8028982 | 0.95 | BBOX1 (0.56) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Azelaic Acid SCHEMBL8029012 | 0.93 | BBOX1 (0.54) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Adipic Acid SCHEMBL5874733 | 0.92 | BBOX1 (0.58) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Azelaic Acid SCHEMBL8778169 | 0.90 | BBOX1 (0.56) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Sebacic Acid SCHEMBL5874751 | 0.90 | BBOX1 (0.56) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Tetrylammonium SCHEMBL5875099 | 0.89 | BBOX1 (0.50) | BBOX1CA1FABP3 | |
| Tetrylammonium SCHEMBL5574992 | 0.88 | CA1 (0.73) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Tetrylammonium SCHEMBL5874609 | 0.87 | FFAR3 (0.55) | BBOX1CA1FFAR3HDAC3HDAC1 | |
| Tetrylammonium SCHEMBL5571730 | 0.86 | CA1 (0.62) | BBOX1CA1FABP3NFKB1 |
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-5733661-A | METAL OXIDE CONTAINING IONS OF AN ORGANIC CARBOXYLIC ACID SALT AND/OR IONS OF AN INORGANIC OXOACID SALT | MITSUBISHI CHEMICAL CORPORATION (JP) | 1998-03-31 | — | — | US | disclosed |