Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | NMT1 | P30419 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | APLNR | P35414 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL47042 | 0.97 | — | — | |
| Fluoride SCHEMBL27726514 | 0.95 | HDAC1 (0.44) | HDAC1HDAC6ALDH1A1MAPTMEN1 | |
| Hydrochloric Acid SCHEMBL27656812 | 0.95 | HDAC1 (0.44) | HDAC1HDAC6ALDH1A1MAPTMEN1 | |
| SCHEMBL5347385 | 0.80 | ACHE (0.40) | ALDH1A1MAPTMEN1KMT2ADGAT1 | |
| SCHEMBL30337581 | 0.77 | — | — | |
| SCHEMBL13470 | 0.77 | — | — | |
| SCHEMBL2347585 | 0.76 | DGAT1 (0.46) | ALDH1A1MAPTMEN1KMT2ADGAT1 | |
| SCHEMBL3735885 | 0.76 | ALDH1A1 (0.43) | ALDH1A1MAPTMEN1KMT2AACHE | |
| SCHEMBL6246291 | 0.74 | ALDH1A1 (0.44) | HDAC1HDAC6ALDH1A1MAPTMEN1 | |
| SCHEMBL8146926 | 0.73 | CYP2A6 (0.46) | ALDH1A1MAPTMEN1KMT2ADGAT1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3224269-A1 | COMPOSITIONS AND METHODS FOR TREATING CNS DISORDERS | Sage Therapeutics, Inc. (US) | 2017-10-04 | — | — | EP | disclosed |
| WO-2016082789-A1 | COMPOSITIONS AND METHODS FOR TREATING CNS DISORDERS | SAGE THERAPEUTICS, INC. (US) | 2016-06-02 | — | — | WO | disclosed |
| CN-1167687-C | Arylpyridazinones as prostaglandin endoperoxide H synthase biosynthesis inhibitors | ���Ͽع�����˾ | 2004-09-22 | — | — | CN | disclosed |
| CN-1277605-A | Arylpyridazinones as prostaglandin endoperoxide H synthase biosynthesis inhibitors | ABBOTT LAB (US) | 2000-12-20 | — | — | CN | disclosed |