Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28297202 | 0.78 | TSHR (0.39) | — | |
| SCHEMBL1244409 | 0.75 | — | — | |
| SCHEMBL28829313 | 0.71 | DPP4 (0.52) | TAAR1 | |
| SCHEMBL3790606 | 0.71 | LOXL2 (0.54) | LOXL2TAAR1CSNK2A1HRH3ROCK1 | |
| SCHEMBL3789650 | 0.71 | CSNK2A1 (0.59) | LOXL2TAAR1CSNK2A1HRH3ROCK1 | |
| SCHEMBL3790111 | 0.70 | MAP4K4 (0.46) | LOXL2TAAR1CSNK2A1HRH3 | |
| SCHEMBL27414053 | 0.69 | LOXL2 (0.37) | LOXL2TAAR1 | |
| SCHEMBL27784685 | 0.69 | LOXL2 (0.37) | LOXL2TAAR1 | |
| SCHEMBL7861005 | 0.69 | — | — | |
| SCHEMBL28297213 | 0.68 | CYP3A4 (0.39) | — |
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-109906220-A | For treating the 1,3- dihydro -1,4- benzodiazepine * -2- thione compounds of CNS related disease | 豪夫迈·罗氏有限公司 | 2019-06-18 | — | — | CN | disclosed |