Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 14/20 | 0.58 |
| ▸ | BACE1 | P56817 | 14/20 | 0.58 |
| ▸ | BCHE | P06276 | 12/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | FYN | P06241 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.46 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL24928272 | 0.81 | ACHE (0.54) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL9965855 | 0.81 | ACHE (0.54) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL18471685 | 0.78 | ACHE (0.51) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL663239 | 0.77 | GRIN2B (0.74) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL25093393 | 0.77 | ACHE (0.50) | ACHEBACE1BCHEGRIN2BMEN1 | |
| Hydrochloric Acid SCHEMBL2550113 | 0.75 | MEN1 (0.78) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL18484552 | 0.75 | ACHE (0.49) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL5750794 | 0.75 | BCHE (0.49) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL1373875 | 0.74 | ACHE (0.51) | ACHEBACE1BCHEGRIN2BMEN1 | |
| SCHEMBL5692288 | 0.74 | ACHE (1.00) | ACHEBACE1BCHEMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2651898-B1 | NOVEL N-(4-(AZETIDINE-1-CARBONYL)PHENYL)-(HETERO-)ARYLSULFONAMIDE DERIVATIVES AS PYRUVATE KINASE M2 (PMK2) MODULATORS | AGIOS PHARMACEUTICALS INC (US) | 2015-12-09 | — | — | EP | disclosed |