Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | F2RL1 | P55085 | 7/20 | 0.33 |
| ▸ | BRD4 | O60885 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8629576 | 0.82 | BRD4 (0.44) | CES2CES1HDAC6BRD4 | |
| SCHEMBL8636185 | 0.78 | BRD4 (0.43) | BRD4CREBBP | |
| SCHEMBL3909922 | 0.73 | CES2 (0.55) | CES2CES1 | |
| SCHEMBL8634802 | 0.73 | ALDH1A1 (0.38) | — | |
| SCHEMBL8632301 | 0.72 | GAA (0.44) | BRD4GAA | |
| SCHEMBL8632971 | 0.71 | NOTUM (0.38) | GAA | |
| SCHEMBL9026125 | 0.69 | BRD4 (0.36) | BRD4CREBBP | |
| SCHEMBL8633722 | 0.68 | BRD4 (0.41) | BRD4CREBBP | |
| SCHEMBL8634779 | 0.67 | KMT2A (0.38) | — | |
| SCHEMBL8634032 | 0.67 | IMPDH2 (0.39) | BRD4CREBBP |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5712299-A | TREATMENT OF NEURODEGENERATIVE DISORDERS | ASTRA AKTIEBOLAG (SE) | 1998-01-27 | — | — | US | disclosed |
| EP-0707574-A1 | NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES | Astra Aktiebolag (SE) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995001968-A1 | NOVEL (1-PHENYL-1-HETEROCYCLYL)METHANOL AND (1-PHENYL-1-HETEROCYCLYL)METHYLAMINE DERIVATIVES | ASTRA AKTIEBOLAG (SE) | 1995-01-19 | — | — | WO | disclosed |