Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 14/20 | 0.44 |
| ▸ | QPCT | Q16769 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | RAF1 | P04049 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1645880 | 0.77 | AR (0.50) | ARQPCTCYP3A4MAPTMEN1 | |
| SCHEMBL9205457 | 0.75 | AR (0.75) | ARQPCTCYP3A4MAPTMEN1 | |
| SCHEMBL9200343 | 0.74 | BCHE (0.54) | ARQPCTCYP3A4MAPTMEN1 | |
| Water SCHEMBL11654213 | 0.73 | GPR35 (0.59) | ARQPCTCYP3A4MAPTMEN1 | |
| SCHEMBL1645772 | 0.72 | AR (0.54) | ARQPCTCYP3A4MAPTMEN1 | |
| SCHEMBL311277 | 0.68 | TNKS (0.75) | ARQPCTCYP3A4MAPTALDH1A1 | |
| SCHEMBL16521508 | 0.67 | ABCB1 (0.55) | QPCTCYP3A4MAPTMEN1KMT2A | |
| SCHEMBL28637044 | 0.66 | CYP3A4 (0.56) | ARCYP3A4MAPTMEN1KMT2A | |
| SCHEMBL28762687 | 0.65 | CCNC (0.84) | ARCYP3A4MAPTMEN1KMT2A | |
| SCHEMBL28044360 | 0.65 | CYP3A4 (0.66) | ARCYP3A4MAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0430693-A2 | Pyrimidinedione derivative compounds, method for preparing same, and antiarrhythmic agents containing same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1991-06-05 | — | — | EP | disclosed |