Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | TACR3 | P29371 | 6/20 | 0.60 |
| ▸ | TACR2 | P21452 | 3/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL6448666 | 0.88 | TACR3 (0.60) | ALDH1A1HPGDTP53LMNAMAPT | |
| SCHEMBL6449830 | 0.88 | TACR3 (0.61) | ALDH1A1HPGDTP53LMNATACR3 | |
| SCHEMBL6447781 | 0.88 | ALDH1A1 (0.73) | ALDH1A1HPGDTP53LMNAMAPT | |
| SCHEMBL6451528 | 0.87 | LMNA (0.66) | ALDH1A1HPGDTP53LMNAMAPT | |
| SCHEMBL8226622 | 0.87 | ALDH1A1 (0.64) | ALDH1A1HPGDTP53LMNAMAPT | |
| SCHEMBL6448792 | 0.87 | LMNA (0.65) | ALDH1A1HPGDTP53LMNAMAPT | |
| SCHEMBL6451847 | 0.86 | ALDH1A1 (0.55) | ALDH1A1HPGDTP53LMNAMAPT | |
| SCHEMBL14523182 | 0.84 | LMNA (0.79) | ALDH1A1HPGDTP53LMNAMAPT | |
| SCHEMBL6450548 | 0.84 | TACR3 (0.63) | ALDH1A1HPGDTP53LMNAMAPT | |
| Hydrochloric Acid SCHEMBL6449066 | 0.83 | TACR3 (0.62) | ALDH1A1HPGDTP53LMNATACR3 |
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-1517708-A1 | COMBINATION TREATMENT FOR DEPRESSION AND ANXIETY BY NK1 AND NK3 ANTAGONISTS | Pfizer Products Inc. (US) | 2005-03-30 | — | — | EP | claimed |
| WO-2004000355-A1 | COMBINATION TREATMENT FOR DEPRESSION AND ANXIETY BY NK1 AND NK3 ANTAGONISTS | PFIZER PRODUCTS INC. (US) | 2003-12-31 | — | — | WO | claimed |
| EP-1517708-A1 | COMBINATION TREATMENT FOR DEPRESSION AND ANXIETY BY NK1 AND NK3 ANTAGONISTS | Pfizer Products Inc. (US) | 2005-03-30 | — | — | EP | disclosed |
| WO-2004000355-A1 | COMBINATION TREATMENT FOR DEPRESSION AND ANXIETY BY NK1 AND NK3 ANTAGONISTS | PFIZER PRODUCTS INC. (US) | 2003-12-31 | — | — | WO | disclosed |