Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.57 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.57 |
| ▸ | DRD2 | P14416 | 1/20 | 0.57 |
| ▸ | HTR2A | P28223 | 1/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.57 |
| ▸ | DRD3 | P35462 | 1/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.56 |
| ▸ | CTSS | P25774 | 1/20 | 0.53 |
| ▸ | PLD2 | O14939 | 1/20 | 0.53 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11024904 | 0.96 | HTR1A (0.57) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11099809 | 0.96 | HTR1A (0.55) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11025222 | 0.94 | HTR1A (0.59) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11027738 | 0.92 | HTR1A (0.60) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11023582 | 0.90 | OPRM1 (0.54) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11024054 | 0.90 | DRD2 (0.55) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| Axamozide SCHEMBL11022863 | 0.89 | OPRM1 (0.60) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11023441 | 0.89 | DRD3 (0.58) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11096897 | 0.89 | HTR1A (0.56) | HTR1AADRA2ADRD2HTR2ASLC6A4 | |
| SCHEMBL11101398 | 0.88 | DRD2 (0.62) | HTR1ADRD2HTR2ADRD3CHRM1 |
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-0068261-B1 | N-OXACYCLYL-ALKYLPIPERIDINE DERIVATIVES, THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR USE | HOECHST AKTIENGESELLSCHAFT (DE) | 1985-04-03 | — | — | EP | disclosed |
| US-4470989-A | Neuroleptic n-oxacyclyl-alkylpiperidine derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-09-11 | — | — | US | disclosed |