Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 11/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.43 |
| ▸ | HTR1A | P08908 | 4/20 | 0.43 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.41 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL1006493 | 0.77 | IKBKB (0.53) | PARP1SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL28853765 | 0.76 | PARP1 (0.52) | PARP1IKBKBCHUKPARP2AURKA | |
| Hydrochloric Acid SCHEMBL28243995 | 0.76 | HTR2C (0.53) | PARP1SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL3809376 | 0.75 | HTR2C (0.59) | PARP1IKBKBCHUKPARP2HTR2C | |
| SCHEMBL19284594 | 0.75 | PARP1 (0.51) | PARP1IKBKBCHUKPARP2AURKA | |
| Hydrochloric Acid SCHEMBL27587929 | 0.74 | HTR2C (0.60) | PARP1IKBKBCHUKPARP2HTR2C | |
| SCHEMBL4693211 | 0.73 | PARP1 (0.44) | PARP1AURKARPS6KB1 | |
| SCHEMBL17185049 | 0.73 | PARP1 (0.46) | PARP1IKBKBCHUKPARP2AURKA | |
| SCHEMBL28325510 | 0.73 | PARP1 (0.57) | PARP1IKBKBCHUKPARP2AURKA | |
| SCHEMBL30554038 | 0.72 | PARP1 (0.56) | PARP1SLC6A2SLC6A4SLC6A3IKBKB |
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-2619180-A1 | 5-HT2B RECEPTOR ANTAGONISTS | Janssen Pharmaceutica, N.V. (BE) | 2013-07-31 | — | — | EP | disclosed |
| WO-2012028614-A1 | 5-HT2B RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2012-03-08 | — | — | WO | disclosed |