Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.39 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8551228 | 0.89 | BRD4 (0.49) | BRD4 | |
| SCHEMBL5463742 | 0.84 | CYP2C9 (0.44) | BRD4CYP2C9MEN1CYP2D6KMT2A | |
| SCHEMBL5742269 | 0.80 | CES2 (0.46) | BRD4HDAC4HDAC7HDAC5FFAR2 | |
| SCHEMBL9298515 | 0.80 | BRD4 (0.45) | BRD4HDAC4HDAC7HDAC5FFAR2 | |
| SCHEMBL16601483 | 0.80 | ESR1 (0.50) | BRD4CYP2C9MEN1CYP2D6CYP2C19 | |
| SCHEMBL9298853 | 0.80 | CES2 (0.52) | BRD4HDAC4HDAC7HDAC5CYP2C9 | |
| SCHEMBL75753 | 0.80 | CES2 (0.52) | BRD4HDAC4HDAC7HDAC5CYP2C9 | |
| SCHEMBL5559079 | 0.80 | CYP1A2 (0.55) | CYP2C19CES2CES1NFKB1CNR1 | |
| SCHEMBL75858 | 0.80 | BRD4 (0.45) | BRD4HDAC4HDAC7HDAC5FFAR2 | |
| SCHEMBL22445731 | 0.78 | BRD4 (0.39) | BRD4MEN1KMT2ACES2CES1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-7011195-A | — | — | None | — | — | JP | disclosed |
| EP-2603214-A1 | HETEROARYLS AND USES THEREOF | Millennium Pharmaceuticals, Inc. (US) | 2013-06-19 | — | — | EP | disclosed |
| WO-2012021696-A1 | HETEROARYLS AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-02-16 | — | — | WO | disclosed |
| EP-2173743-A2 | SODIUM CHANNEL INHIBITORS | Icagen, Inc. (US) | 2010-04-14 | — | — | EP | disclosed |
| WO-2009012242-A2 | SODIUM CHANNEL INHIBITORS | ICAGEN, INC. (US) | 2009-01-22 | — | — | WO | disclosed |
| JP-H0711195-A | WAX | TAJIMA INC | 1995-01-13 | — | — | JP | disclosed |