Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | HTR1A | P08908 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | HTR7 | P34969 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL5373264 | 0.94 | ALDH1A1 (0.67) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| SCHEMBL4512612 | 0.91 | ALDH1A1 (0.71) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| Hydrochloric Acid SCHEMBL3844581 | 0.90 | ALDH1A1 (0.69) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| SCHEMBL14578165 | 0.87 | ALDH1A1 (0.58) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| SCHEMBL14578041 | 0.87 | ACHE (0.60) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| Hydrochloric Acid SCHEMBL5353278 | 0.87 | HTR1A (0.67) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| Hydrochloric Acid SCHEMBL7293384 | 0.86 | HTR1A (0.66) | ALDH1A1HTR1AKMT2AACHEGFER | |
| Hydrochloric Acid SCHEMBL5373236 | 0.86 | ACHE (0.58) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| Hydrochloric Acid SCHEMBL5372870 | 0.86 | ALDH1A1 (0.57) | ALDH1A1HTR1AKMT2AACHEHTR7 | |
| Hydrochloric Acid SCHEMBL5358391 | 0.86 | ALDH1A1 (0.73) | ALDH1A1KMT2AACHECYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7173132-B2 | Certain substituted 1-aryl-3-piperazine-1′-yl propanones | MOLECULAR GERIATRICS CORPORATION (US) | 2007-02-06 | — | — | US | disclosed |
| US-7173132-B2 | Certain substituted 1-aryl-3-piperazine-1′-yl propanones | MOLECULAR GERIATRICS CORPORATION (US) | 2007-02-06 | — | — | US | disclosed |