Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 7/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1253622 | 0.84 | TAAR1 (0.79) | TAAR1LMNAHTTALDH1A1THRB | |
| SCHEMBL27751635 | 0.83 | CYP2D6 (0.50) | TAAR1LMNAHTTALDH1A1THRB | |
| Hydrochloric Acid SCHEMBL30459386 | 0.82 | TAAR1 (0.76) | TAAR1LMNAHTTALDH1A1THRB | |
| Hydrochloric Acid SCHEMBL26657866 | 0.82 | TAAR1 (0.76) | TAAR1LMNAHTTALDH1A1THRB | |
| SCHEMBL19904410 | 0.81 | TAAR1 (0.62) | TAAR1LMNAHTTALDH1A1THRB | |
| SCHEMBL8255914 | 0.80 | TAAR1 (0.52) | TAAR1LMNAHTTALDH1A1THRB | |
| SCHEMBL4081586 | 0.80 | TAAR1 (0.52) | TAAR1LMNAHTTALDH1A1THRB | |
| SCHEMBL315045 | 0.80 | TAAR1 (0.52) | TAAR1LMNAHTTALDH1A1THRB | |
| SCHEMBL3777135 | 0.80 | TAAR1 (0.52) | TAAR1LMNAHTTALDH1A1THRB | |
| SCHEMBL5657606 | 0.80 | TAAR1 (0.52) | TAAR1LMNAHTTALDH1A1THRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-107628926-B | Preparation method of monofluoroethyl substituted aromatic compound | 四川理工学院 | 2020-07-28 | — | — | CN | disclosed |