Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 15/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21674980 | 0.84 | BRD4 (0.73) | BRD4HTTMAPTALDH1A1NPC1 | |
| SCHEMBL16722565 | 0.84 | BRD4 (0.73) | BRD4HTTMAPTALDH1A1NPC1 | |
| SCHEMBL21532044 | 0.84 | BRD4 (0.67) | BRD4HTTMAPTNPC1RAB9A | |
| SCHEMBL16723056 | 0.82 | BRD4 (0.64) | BRD4HTTMAPTNPC1RAB9A | |
| SCHEMBL16722998 | 0.82 | BRD4 (0.67) | BRD4HTTMAPTALDH1A1RAB9A | |
| SCHEMBL17021684 | 0.80 | BRD4 (0.64) | BRD4HTTMAPTALDH1A1NPC1 | |
| SCHEMBL16723209 | 0.80 | BRD4 (0.67) | BRD4HTTMAPTNPC1RAB9A | |
| SCHEMBL16723013 | 0.80 | BRD4 (0.63) | BRD4HTTMAPT | |
| SCHEMBL18060440 | 0.79 | BRD4 (0.66) | BRD4HTTMAPTALDH1A1NPC1 | |
| SCHEMBL18067098 | 0.79 | BRD4 (0.66) | BRD4HTTMAPTALDH1A1NPC1 |
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-2015074081-A1 | BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS | BAIR KENNETH W (US) | 2015-05-21 | — | — | WO | disclosed |