Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.56 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | MPO | P05164 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | DAO | P14920 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8526001 | 0.78 | TAAR1 (0.75) | TAAR1AOC3IDO1MPOMAOB | |
| SCHEMBL12245650 | 0.77 | TAAR1 (0.48) | TAAR1AOC3IDO1HPGDLMNA | |
| SCHEMBL29953492 | 0.77 | TAAR1 (0.48) | TAAR1AOC3IDO1HPGDLMNA | |
| SCHEMBL5547480 | 0.75 | TAAR1 (0.62) | TAAR1AOC3IDO1MPOMAOB | |
| SCHEMBL29952113 | 0.74 | TAAR1 (0.54) | TAAR1DAOHPGDLMNAALDH1A1 | |
| SCHEMBL30660239 | 0.74 | TAAR1 (0.68) | TAAR1AOC3IDO1MPOMAOB | |
| SCHEMBL29401035 | 0.72 | TAAR1 (1.00) | TAAR1AOC3IDO1MPOMAOB | |
| SCHEMBL575058 | 0.72 | TAAR1 (0.73) | TAAR1AOC3IDO1MPOMAOB | |
| SCHEMBL158935 | 0.72 | TAAR1 (1.00) | TAAR1AOC3IDO1MPOMAOB | |
| SCHEMBL5609925 | 0.70 | TAAR1 (0.62) | TAAR1AOC3IDO1MPOMAOB |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |