Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 10/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 10/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 10/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.42 |
| ▸ | GSR | P00390 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.39 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL8957460 | 0.91 | SLC6A2 (0.42) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| Nitric Acid SCHEMBL9874607 | 0.83 | UGT2B7 (0.44) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL9873911 | 0.78 | UGT2B7 (0.55) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL28589633 | 0.72 | SLC6A2 (0.49) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL28589635 | 0.72 | SLC6A2 (0.49) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL7677415 | 0.70 | HDAC1 (0.49) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL28830517 | 0.69 | UGT2B7 (0.46) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL28830520 | 0.69 | UGT2B7 (0.46) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL8950399 | 0.68 | UGT2B7 (0.53) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 | |
| SCHEMBL6300038 | 0.68 | ALDH1A1 (0.56) | CYP2D6SLC6A2SLC6A4SLC6A3CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5049694-A | Cardiovascular disorders | CEDONA PHARMACEUTICALS B.V. (NL) | 1991-09-17 | — | — | US | disclosed |