Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
| ▸ | CHUK | O15111 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 11/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | HTR1A | P08908 | 2/20 | 0.45 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20400462 | 0.81 | PARP1 (0.44) | IKBKBCHUKPARP1SLC6A2SLC6A4 | |
| SCHEMBL1006493 | 0.80 | IKBKB (0.53) | IKBKBCHUKPARP1SLC6A2SLC6A4 | |
| SCHEMBL23111536 | 0.79 | GABRA1 (0.49) | SLC6A2SLC6A4SLC6A3HTR1AHTR2C | |
| Hydrochloric Acid SCHEMBL28243995 | 0.79 | HTR2C (0.53) | IKBKBCHUKPARP1SLC6A2SLC6A4 | |
| SCHEMBL15533083 | 0.78 | PARP1 (0.44) | IKBKBCHUKPARP1SLC6A2SLC6A4 | |
| SCHEMBL28853765 | 0.76 | PARP1 (0.52) | IKBKBCHUKPARP1PARP2HTR2C | |
| SCHEMBL3809376 | 0.75 | HTR2C (0.59) | IKBKBCHUKPARP1PARP2HTR2C | |
| SCHEMBL19284594 | 0.75 | PARP1 (0.51) | IKBKBCHUKPARP1PARP2HTR2C | |
| SCHEMBL30554038 | 0.75 | PARP1 (0.56) | IKBKBCHUKPARP1SLC6A2SLC6A4 | |
| SCHEMBL25422738 | 0.74 | PARP1 (0.47) | IKBKBCHUKPARP1SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018136546-A1 | SUBSTITUTED 3-DIALKYLAMINOMETHYL-PIPERIDIN-4-YL-BENZAMIDES AND METHODS OF MAKING AND USING SAME | MEBIAS DISCOVERY LLC (US) | 2018-07-26 | — | — | WO | disclosed |