Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 5/20 | 0.68 |
| ▸ | DRD2 | P14416 | 4/20 | 0.68 |
| ▸ | HTR1A | P08908 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | DRD3 | P35462 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7974099 | 1.00 | HTR2A (0.68) | HTR2ADRD2HTR1AALDH1A1MAPT | |
| SCHEMBL1545448 | 0.86 | HTR2A (0.77) | HTR2ADRD2HTR1ADRD3ACHE | |
| SCHEMBL5368375 | 0.84 | HTR2A (0.72) | HTR2ADRD2HTR1ADRD3ACHE | |
| SCHEMBL5368366 | 0.84 | HTR2A (0.72) | HTR2ADRD2HTR1ADRD3ACHE | |
| SCHEMBL7496035 | 0.82 | HTR2A (0.69) | HTR2ADRD2HTR1ADRD3ACHE | |
| Hydrochloric Acid SCHEMBL1545656 | 0.81 | ACHE (0.69) | HTR2ADRD2HTR1AACHESLC6A4 | |
| SCHEMBL15703012 | 0.81 | KCNH2 (0.74) | HTR2ADRD2HTR1AALDH1A1MAPT | |
| SCHEMBL7977213 | 0.80 | HTR2A (0.60) | HTR2ADRD2HTR1AACHESLC6A4 | |
| SCHEMBL1545018 | 0.80 | DRD2 (0.72) | HTR2ADRD2HTR1AACHESLC6A4 | |
| SCHEMBL20512970 | 0.80 | DRD2 (1.00) | HTR2ADRD2HTR1ADRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001017993-A1 | ALKYLPIPERIDI NYLBENZO [D] ISOXAZOLE DERIVATIVES HAVING PSYCHOTROPIC ACTIVITY, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME, AND A PROCESS FOR THE PREPARATION OF THE ACTIVE INGREDIENT | EGIS Gyógyszergyár Rt. (HU) | 2001-03-15 | — | — | WO | disclosed |