Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GRK2 | P25098 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 2/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Tetrabuthylammonium SCHEMBL9416010 | 0.85 | SLC22A1 (0.41) | SLC22A1MEN1KMT2AL3MBTL1MAPT | |
| Tetrabuthylammonium SCHEMBL105664 | 0.84 | SLC22A1 (0.52) | SLC22A1CA2SLC22A2CA1 | |
| Tetrabuthylammonium SCHEMBL107485 | 0.79 | SLC22A1 (0.46) | SLC22A1CA2SLC22A2CA1 | |
| Tetrabuthylammonium SCHEMBL2476050 | 0.78 | SLC22A1 (0.50) | SLC22A1SLC22A2FAAH | |
| Tetrabuthylammonium SCHEMBL2350563 | 0.78 | SLC22A1 (0.55) | SLC22A1CA2SLC22A2 | |
| Tetrabuthylammonium SCHEMBL5988879 | 0.76 | SLC22A1 (0.52) | SLC22A1CA2SLC22A2 | |
| SCHEMBL31088020 | 0.75 | SLC22A1 (0.41) | SLC22A1SLC22A2CA1FAAH | |
| Tetrabuthylammonium SCHEMBL106861 | 0.73 | SLC22A1 (0.67) | SLC22A1SLC22A2 | |
| Tetrahexylammonium SCHEMBL16115778 | 0.73 | SLC22A1 (0.52) | SLC22A1SLC22A2FAAH | |
| SCHEMBL16115105 | 0.73 | SLC22A1 (0.52) | SLC22A1SLC22A2FAAH |
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 |
|---|---|---|---|---|---|---|---|
| EP-0599265-A1 | Antibacterial, antifungal compound and its production method | Takeda Chemical Industries, Ltd. (JP) | 1994-06-01 | — | — | EP | disclosed |