Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14972583 | 0.81 | TAAR1 (0.52) | TAAR1IDO1HCAR2HRH3DAO | |
| SCHEMBL23267595 | 0.81 | TAAR1 (0.52) | TAAR1IDO1HCAR2HRH3DAO | |
| SCHEMBL10378465 | 0.81 | TAAR1 (0.52) | TAAR1IDO1HCAR2HRH3DAO | |
| SCHEMBL12680901 | 0.81 | TAAR1 (0.47) | TAAR1IDO1HRH3DAOALDH1A1 | |
| SCHEMBL10204847 | 0.80 | TAAR1 (0.53) | TAAR1IDO1HCAR2HRH3DAO | |
| SCHEMBL16353984 | 0.80 | KCNH2 (0.47) | TAAR1IDO1HCAR2HRH3KCNH2 | |
| SCHEMBL10204846 | 0.78 | TAAR1 (0.55) | TAAR1IDO1HCAR2HRH3DAO | |
| SCHEMBL13225854 | 0.77 | FFAR4 (0.41) | TAAR1HCAR2DAOALOX5MAOB | |
| SCHEMBL10035696 | 0.75 | IDO1 (0.60) | TAAR1IDO1HRH3MAOB | |
| SCHEMBL2608904 | 0.73 | TAAR1 (0.50) | TAAR1IDO1HCAR2HRH3DAO |
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 |
|---|---|---|---|---|---|---|---|
| EP-2824108-B1 | TETRACYCLIC ANTHRAQUINONE DERIVATIVES | TIANJIN HEMAY BIO-TECH CO LTD (CN) | 2017-04-19 | — | — | EP | disclosed |
| EP-2824108-A1 | TETRACYCLIC ANTHRAQUINONE DERIVATIVES | Tianjin Hemay Bio-Tech Co., Ltd. (CN) | 2015-01-14 | — | — | EP | disclosed |