Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3231884 | 0.88 | SCN9A (0.41) | SCN9ASLC6A2SLC6A4SLC6A3MEN1 | |
| SCHEMBL3222271 | 0.88 | SLC6A2 (0.47) | SCN9ASLC6A2SLC6A4SLC6A3MEN1 | |
| SCHEMBL3227105 | 0.87 | SCN9A (0.38) | SCN9ASLC6A2SLC6A4SLC6A3HRH4 | |
| SCHEMBL3227250 | 0.85 | SCN9A (0.39) | SCN9ASLC6A2SLC6A4SLC6A3MEN1 | |
| SCHEMBL3232472 | 0.85 | SCN9A (0.45) | SCN9ASLC6A2SLC6A4SLC6A3MEN1 | |
| SCHEMBL3479668 | 0.85 | SCN9A (0.41) | SCN9ASLC6A2SLC6A4SLC6A3MEN1 | |
| SCHEMBL3231435 | 0.84 | SCN9A (0.44) | SCN9ASLC6A2SLC6A4SLC6A3MEN1 | |
| SCHEMBL3225091 | 0.84 | SCN9A (0.43) | SCN9ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL3232804 | 0.84 | SLC6A2 (0.45) | SCN9ASLC6A2SLC6A4SLC6A3MEN1 | |
| SCHEMBL3230004 | 0.83 | SCN9A (0.45) | SCN9ASLC6A2SLC6A4SLC6A3ALDH1A1 |
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-2146722-A1 | ARYL- AND HETEROARYL-SUBSTITUTED TETRAHYDROBENZO-1,4-DIAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN | AMR Technology, Inc. (US) | 2010-01-27 | — | — | EP | disclosed |
| WO-2008141081-A1 | ARYL- AND HETEROARYL-SUBSTITUTED TETRAHYDROBENZO-1,4-DIAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN | AMR TECHNOLOGY, INC. (US) | 2008-11-20 | — | — | WO | disclosed |