Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 3/20 | 0.40 |
| ▸ | AGXT | P21549 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.40 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.40 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.40 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10824095 | 0.94 | MAOB (0.50) | KCNH2TAAR1AOC3HTR3EHTR3B | |
| SCHEMBL7783414 | 0.86 | GRIN2D (0.45) | KCNH2TAAR1AOC3HTR3EHTR3B | |
| SCHEMBL7783410 | 0.86 | GRIN2D (0.45) | KCNH2TAAR1AOC3HTR3EHTR3B | |
| SCHEMBL7783407 | 0.86 | GRIN2D (0.45) | KCNH2TAAR1AOC3HTR3EHTR3B | |
| SCHEMBL14046106 | 0.85 | MAOB (0.46) | KCNH2TAAR1AOC3MAOBSLC6A4 | |
| SCHEMBL13639180 | 0.84 | KCNH2 (0.46) | KCNH2TAAR1AOC3HTR3EHTR3B | |
| SCHEMBL14046070 | 0.83 | MAOB (0.47) | KCNH2TAAR1AOC3HTR3EHTR3B | |
| SCHEMBL432651 | 0.82 | TAAR1 (0.50) | KCNH2TAAR1AOC3HTR3EHTR3B | |
| SCHEMBL10009929 | 0.82 | HRH3 (0.43) | KCNH2MAOBHDAC2HDAC8 | |
| SCHEMBL27666245 | 0.81 | KCNH2 (0.55) | KCNH2TAAR1AOC3HTR3EHTR3B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100497345-C | 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis | OTSUKA PHARMA CO LTD (JP) | 2009-06-10 | — | — | CN | disclosed |
| CN-1878777-A | 2,3-dihydro-6-nitroimidazo (2,1-b) oxazole compounds for the treatment of tuberculosis | OTSUKA PHARMA CO LTD (JP) | 2006-12-13 | — | — | CN | disclosed |
| WO-1995016676-A1 | ARTHROPODICIDAL PENTAFLUOROTHIO SUBSTITUTED ANILIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1995-06-22 | — | — | WO | disclosed |