Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 6/20 | 0.50 |
| ▸ | HTR2A | P28223 | 5/20 | 0.50 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9875298 | 0.94 | HRH1 (0.48) | HRH1HTR2AGRM2GRM3SIGMAR1 | |
| SCHEMBL7199830 | 0.92 | HRH1 (0.47) | HRH1HTR2AGRM2GRM3SIGMAR1 | |
| SCHEMBL21913847 | 0.88 | HRH1 (0.46) | HRH1HTR2ASRCMTNR1AMTNR1B | |
| SCHEMBL7076936 | 0.86 | RIPK1 (0.47) | SRCALDH1A1CYP2C19 | |
| SCHEMBL972987 | 0.86 | RIPK1 (0.47) | SRCALDH1A1CYP2C19 | |
| SCHEMBL7075226 | 0.86 | RIPK1 (0.47) | SRCALDH1A1CYP2C19 | |
| SCHEMBL3139496 | 0.83 | SRC (0.39) | HRH1HTR2ASRCALDH1A1CYP2C19 | |
| SCHEMBL3129679 | 0.83 | SRC (0.39) | HRH1HTR2ASRCMTNR1AMTNR1B | |
| SCHEMBL3129720 | 0.83 | CYP2C19 (0.41) | HRH1HTR2ASRCALDH1A1CYP2C19 | |
| SCHEMBL3139395 | 0.83 | SRC (0.39) | HRH1HTR2ASRCMTNR1AMTNR1B |
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-0542846-A1 | N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-05-26 | — | — | EP | disclosed |
| WO-1992002502-A1 | N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1992-02-20 | — | — | WO | disclosed |