Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EP300 | Q09472 | 1/20 | 0.35 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4373779 | 1.00 | EP300 (0.35) | EP300ZDHHC7ABCB1FAAHTP53 | |
| SCHEMBL4373427 | 0.90 | EP300 (0.36) | EP300ZDHHC7ABCB1FAAHTP53 | |
| SCHEMBL4053615 | 0.80 | EP300 (0.36) | EP300ZDHHC7FAAHTP53MEN1 | |
| SCHEMBL4050502 | 0.80 | EP300 (0.36) | EP300ZDHHC7FAAHTP53MEN1 | |
| SCHEMBL4052380 | 0.74 | NPC1 (0.40) | EP300FAAHCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4055070 | 0.74 | NPC1 (0.40) | EP300FAAHCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4056607 | 0.74 | NPC1 (0.40) | EP300FAAHCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4049541 | 0.74 | NPC1 (0.40) | EP300FAAHCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4050986 | 0.72 | CYP1A2 (0.39) | FAAHCYP1A2CYP3A4CYP2C19SOAT1 | |
| Secosubamolide SCHEMBL4373980 | 0.70 | EP300 (0.42) | EP300ZDHHC7FAAHTP53MEN1 |
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-2009110655-A1 | NOVEL BETA SUBSTITUTED MORITA-BAYLIS-HILLMAN DERIVATIVES | SUNGKYUNKWAN UNIVERSITY FOUNDATION FOR CORPORATE COLLABORATION (KR) | 2009-09-11 | — | — | WO | disclosed |