Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 4/20 | 0.44 |
| ▸ | CES2 | O00748 | 3/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4082882 | 0.84 | CES2 (0.58) | CES1CES2PARP1HDAC1HDAC6 | |
| SCHEMBL6317725 | 0.83 | CES2 (0.58) | CES1CES2PARP1MEN1KMT2A | |
| SCHEMBL6313384 | 0.83 | CES2 (0.58) | CES1CES2PARP1MEN1KMT2A | |
| SCHEMBL6312637 | 0.79 | NPC1 (0.48) | CES1CES2MEN1KMT2AKCNK3 | |
| SCHEMBL143 | 0.78 | CES1 (0.53) | CES1CES2PARP1MEN1KMT2A | |
| SCHEMBL2012795 | 0.76 | CNR1 (0.68) | CES1CES2CNR1CNR2PARP1 | |
| SCHEMBL7260110 | 0.76 | CES2 (0.73) | CES1CES2CNR1CNR2PARP1 | |
| SCHEMBL29174157 | 0.76 | MEN1 (0.45) | CES1CES2CNR1CNR2PARP1 | |
| Bromide SCHEMBL28972076 | 0.74 | CES1 (0.50) | CES1CES2PARP1MEN1KMT2A | |
| Methane SCHEMBL29155195 | 0.74 | CES1 (0.50) | CES1CES2PARP1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6924301-B1 | Composition for treating or preventing arrhythmia | SHIONOGI & CO., LTD. (JP) | 2005-08-02 | — | — | US | disclosed |
| EP-1240906-A1 | PREVENTIVES OR REMEDIES FOR ARRHYTHMIA | SHIONOGI & CO., LTD. (JP) | 2002-09-18 | — | — | EP | disclosed |