Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.57 |
| ▸ | DRD2 | P14416 | 1/20 | 0.55 |
| ▸ | DRD4 | P21917 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8551048 | 0.99 | ADRB2 (0.56) | ADRB2DRD2DRD4HTR2AGAA | |
| SCHEMBL8551065 | 0.95 | DRD4 (0.60) | DRD2DRD4GAA | |
| Hydrochloric Acid SCHEMBL8550602 | 0.93 | DRD2 (0.58) | DRD2DRD4GAA | |
| SCHEMBL8551160 | 0.89 | SCN1A (0.61) | ADRB2HTR2AGAA | |
| SCHEMBL8555980 | 0.89 | ADRB2 (0.56) | ADRB2HTR2AGAA | |
| SCHEMBL8549980 | 0.89 | GPR183 (0.60) | DRD2DRD4 | |
| SCHEMBL8553670 | 0.89 | SCN1A (0.61) | ADRB2DRD2DRD4GAA | |
| SCHEMBL8550706 | 0.88 | DRD2 (0.62) | DRD2DRD4 | |
| SCHEMBL8552599 | 0.88 | SIGMAR1 (0.64) | DRD2DRD4 | |
| SCHEMBL8552224 | 0.88 | CARM1 (0.58) | ADRB2GAA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1084329-C | Benzyl piepridine derivs as pharmaceutical agents | HOFFMANN LA ROCHE (CH) | 2002-05-08 | — | — | CN | disclosed |
| EP-0871613-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 1998-10-21 | — | — | EP | disclosed |
| CN-1183768-A | Benzyl piepridine derivs as pharmaceutical agents | HOFFMANN LA ROCHE (CH) | 1998-06-03 | — | — | CN | disclosed |
| US-5753679-A | SCIZOPHRENIA | HOFFMANN-LA ROCHE INC. (US) | 1998-05-19 | — | — | US | disclosed |
| WO-1996035666-A1 | BENZYL PIPERIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 1996-11-14 | — | — | WO | disclosed |