Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL18965190 | 0.84 | ACHE (0.39) | BACE1AHRSLC9A1BCHEACHE | |
| SCHEMBL248055 | 0.76 | GPR84 (0.37) | BACE1AHRSLC9A1BCHEACHE | |
| SCHEMBL13219676 | 0.76 | CYP2A6 (0.50) | ACHE | |
| SCHEMBL14381324 | 0.75 | POLB (0.38) | MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6435926 | 0.74 | GPR84 (0.36) | BACE1AHRSLC9A1BCHEACHE | |
| SCHEMBL12489705 | 0.72 | ACHE (0.50) | BCHEACHE | |
| SCHEMBL14318048 | 0.72 | ACHE (0.39) | BACE1AHRBCHEACHEMEN1 | |
| Benzene SCHEMBL28694599 | 0.71 | ALDH1A1 (0.50) | BACE1PRNPMEN1KMT2A | |
| SCHEMBL27920022 | 0.69 | SLC9A1 (0.33) | BACE1SLC9A1BCHEACHEMEN1 | |
| SCHEMBL69629 | 0.68 | ALDH1A1 (0.53) | BACE1PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2721019-B1 | THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE | AGIOS PHARMACEUTICALS INC (US) | 2018-08-08 | — | — | EP | disclosed |
| WO-2009143389-A1 | PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS | ARIAD PHARMACEUTICALS, INC. (US) | 2009-11-26 | — | — | WO | disclosed |