Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL9388157 | 0.99 | MAOB (0.58) | MAOBKCNH2HRH3MAOA | |
| SCHEMBL27857326 | 0.89 | SPHK1 (0.57) | MAOBHRH3SPHK1 | |
| SCHEMBL7757730 | 0.82 | MAOB (0.49) | MAOBMAOASPHK1 | |
| SCHEMBL7757734 | 0.82 | MAOB (0.49) | MAOBMAOASPHK1 | |
| SCHEMBL7757747 | 0.81 | MAOB (0.48) | MAOBMAOASPHK1 | |
| SCHEMBL10750550 | 0.81 | MAOB (0.48) | MAOBMAOA | |
| SCHEMBL10750555 | 0.81 | MAOB (0.48) | MAOBMAOA | |
| SCHEMBL7757750 | 0.81 | MAOB (0.48) | MAOBMAOASPHK1 | |
| SCHEMBL10260407 | 0.81 | MAOB (0.61) | MAOBKCNH2MAOA | |
| SCHEMBL7317615 | 0.80 | ALDH1A1 (0.59) | KCNH2HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1061963-A | Be used as the croak pyridine class of the 4-replacement of medicine | SMITH KLINE FRENCH LAB (GB) | 1992-06-17 | — | — | CN | 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 |