Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10350805 | 1.00 | TAAR1 (0.46) | TAAR1IDO1ALDH1A1POLBHRH3 | |
| SCHEMBL7142635 | 0.86 | ALDH1A1 (0.45) | ALDH1A1 | |
| Water SCHEMBL28905301 | 0.84 | ALDH1A1 (0.44) | ALDH1A1 | |
| SCHEMBL3061311 | 0.81 | TAAR1 (0.52) | TAAR1IDO1HRH3 | |
| SCHEMBL29911007 | 0.79 | TAAR1 (0.44) | TAAR1IDO1ALDH1A1POLBHRH3 | |
| SCHEMBL13169319 | 0.78 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL12292914 | 0.78 | CYP1A2 (0.46) | ALDH1A1 | |
| SCHEMBL15761710 | 0.78 | CYP3A4 (0.37) | ALDH1A1 | |
| SCHEMBL27794052 | 0.78 | SLC6A2 (0.41) | TAAR1IDO1HRH3 | |
| SCHEMBL1552428 | 0.77 | SLC6A2 (0.44) | POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110564755-B | Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis | 河南农业大学 | 2021-01-12 | — | — | CN | disclosed |
| CN-110564755-A | Method for preparing (S) -3-phenyl-1, 2-epoxypropane and derivatives thereof by using biological enzyme catalysis | 河南农业大学 | 2019-12-13 | — | — | CN | disclosed |