Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5751432 | 0.89 | MAPT (0.41) | ALDH1A1MAPTMEN1THRBKMT2A | |
| SCHEMBL110854 | 0.86 | ALDH1A1 (0.57) | ALDH1A1MAPTMEN1THRBKMT2A | |
| Hydrochloric Acid SCHEMBL414955 | 0.84 | ALDH1A1 (0.61) | ALDH1A1MAPTMEN1THRBKMT2A | |
| Hydrochloric Acid SCHEMBL20641579 | 0.82 | ALDH1A1 (0.53) | ALDH1A1MAPTMEN1THRBKMT2A | |
| SCHEMBL796074 | 0.78 | ALDH1A1 (0.53) | ALDH1A1MAPTMEN1THRBKMT2A | |
| SCHEMBL1328689 | 0.76 | CA12 (0.42) | ALDH1A1MAPTMEN1THRBKMT2A | |
| SCHEMBL10924833 | 0.74 | SLC6A4 (0.43) | ALDH1A1MAPTMEN1THRBKMT2A | |
| SCHEMBL922966 | 0.70 | ALDH1A1 (0.57) | ALDH1A1MAPTMEN1THRBKMT2A | |
| SCHEMBL926886 | 0.70 | CYP3A4 (0.52) | ALDH1A1MAPTTHRBTDP1KDM4E | |
| SCHEMBL13577188 | 0.70 | DRD4 (0.44) | ALDH1A1MAPTMEN1KMT2AGAA |
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-1377550-A1 | PHENYL HETEROCYCLYL ETHER DERIVATIVES AS SEROTONIN RE-UPTAKE INHIBITORS | Pfizer Limited (GB) | 2004-01-07 | — | — | EP | disclosed |
| WO-2002083643-A1 | PHENYL HETEROCYCLYL ETHER DERIVATIVES AS SEROTONIN RE-UPTAKE INHIBITORS | PFIZER LIMITED (GB) | 2002-10-24 | — | — | WO | disclosed |