Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | MTOR | P42345 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 6/20 | 0.47 |
| ▸ | DRD2 | P14416 | 5/20 | 0.47 |
| ▸ | HTR2A | P28223 | 4/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.47 |
| ▸ | HRH1 | P35367 | 4/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9602632 | 0.90 | MEN1 (0.49) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| SCHEMBL12786020 | 0.76 | DRD3 (0.48) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| SCHEMBL9602299 | 0.75 | HTR2A (0.52) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| SCHEMBL28876807 | 0.75 | CYP3A4 (0.64) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| SCHEMBL9516792 | 0.73 | CYP3A4 (0.63) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| SCHEMBL9602967 | 0.73 | SIGMAR1 (0.79) | DRD2CYP1A2CYP2C9SIGMAR1KDM4E | |
| SCHEMBL9601301 | 0.73 | DRD2 (0.56) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| SCHEMBL9601882 | 0.73 | SIGMAR1 (0.56) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| SCHEMBL9602079 | 0.73 | SLC6A9 (0.55) | CYP3A4CYP2D6FAAHTSHRALOX12 | |
| Hydrochloric Acid SCHEMBL9603075 | 0.72 | SLC6A2 (0.64) | DRD3DRD2HTR2AHRH1SLC6A3 |
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-0308476-B1 | BISPHENYLALKYLPIPERAZINE DERIVATIVES, A METHOD OF THEIR PREPARATION AND A PHARMACEUTICAL PREPARATION | Kabi Pharmacia AB (SE) | 1993-02-03 | — | — | EP | disclosed |
| US-4937245-A | ANTIDEPRESSANTS, ANXIOLYTIC AGENTS | FEX TOMAS (SE) | 1990-06-26 | — | — | US | disclosed |