Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.55 |
| ▸ | DRD2 | P14416 | 2/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | MPO | P05164 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | HTR7 | P34969 | 2/20 | 0.49 |
| ▸ | SCD | O00767 | 1/20 | 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 SCHEMBL1544936 | 0.99 | ACHE (0.54) | ACHEDRD2SLC6A4MPOHTR2A | |
| SCHEMBL461287 | 0.92 | ACHE (0.61) | ACHEDRD2SLC6A4HTR2AHTR7 | |
| Hydrochloric Acid SCHEMBL531052 | 0.90 | ACHE (0.60) | ACHEDRD2SLC6A4HTR2AHTR7 | |
| SCHEMBL20327895 | 0.88 | ACHE (0.56) | ACHEDRD2SLC6A4HTR2AHTR7 | |
| SCHEMBL7726651 | 0.85 | ACHE (0.55) | ACHEDRD2SLC6A4HTR2A | |
| Trifluoroacetic Acid SCHEMBL7453133 | 0.81 | ACHE (0.51) | ACHEDRD2SLC6A4HTR2AHTR7 | |
| SCHEMBL4541441 | 0.80 | ACHE (0.58) | ACHEDRD2SLC6A4HTR2AHTR7 | |
| SCHEMBL187372 | 0.80 | SCD (0.51) | ACHEDRD2SLC6A4SCD | |
| SCHEMBL29688619 | 0.80 | SCD (0.51) | ACHEDRD2SLC6A4SCD | |
| SCHEMBL9377809 | 0.80 | HTR1A (0.39) | ACHEDRD2HTR2A |
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-0612318-A1 | HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-08-31 | — | — | EP | disclosed |
| WO-1993009102-A1 | HETEROARYLPIPERIDINES, PYRROLIDINES AND PIPERAZINES AND THEIR USE AS ANTIPSYCHOTICS AND ANALGETICS | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1993-05-13 | — | — | WO | disclosed |