Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.79 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1813526 | 1.00 | TAAR1 (0.79) | TAAR1CALM1SLC6A4HDAC1HDAC3 | |
| SCHEMBL2471270 | 0.95 | TAAR1 (0.77) | TAAR1CALM1SLC6A4HDAC1HDAC3 | |
| SCHEMBL30928249 | 0.95 | TAAR1 (0.77) | TAAR1CALM1SLC6A4HDAC1HDAC3 | |
| SCHEMBL8422622 | 0.93 | TAAR1 (0.74) | TAAR1CALM1SLC6A4HDAC1HDAC3 | |
| SCHEMBL19772407 | 0.93 | TAAR1 (0.74) | TAAR1CALM1SLC6A4HDAC1HDAC3 | |
| SCHEMBL19904410 | 0.89 | TAAR1 (0.62) | TAAR1CALM1SLC6A4HDAC1HDAC3 | |
| SCHEMBL29633110 | 0.89 | TAAR1 (1.00) | TAAR1CALM1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL632475 | 0.89 | TAAR1 (1.00) | TAAR1CALM1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL108050 | 0.88 | CALM1 (0.72) | TAAR1CALM1SLC6A4HDAC1HDAC3 | |
| Hydrochloric Acid SCHEMBL29836913 | 0.87 | TAAR1 (0.96) | TAAR1CALM1SLC6A4SLC6A2SLC6A3 |
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-118119389-A | Prodrugs and derivatives of des-phosphate nupharicin and uses thereof | 人类生物科学股份有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-109030660-B | Method for extracting and detecting psychotropic drugs in hair | 广东南天司法鉴定所 | 2022-05-31 | — | — | CN | disclosed |