Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | HRH1 | P35367 | 6/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.52 |
| ▸ | SSTR5 | P35346 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9537554 | 0.89 | HRH1 (0.63) | RAB9AHRH1CYP2D6KCNH2MAPT | |
| SCHEMBL9536663 | 0.89 | RAB9A (0.55) | RAB9AHRH1CYP2D6KCNH2MAPT | |
| Hydrochloric Acid SCHEMBL9537670 | 0.89 | RAB9A (0.55) | RAB9AHRH1CYP2D6KCNH2MAPT | |
| SCHEMBL9537523 | 0.88 | RAB9A (0.47) | RAB9AHRH1CYP2D6KCNH2CHRM1 | |
| Hydrochloric Acid SCHEMBL9539517 | 0.88 | HRH1 (0.62) | RAB9AHRH1CYP2D6KCNH2MAPT | |
| SCHEMBL9536543 | 0.87 | SSTR5 (0.66) | TDP1RAB9AHRH1CYP2D6KCNH2 | |
| SCHEMBL9537797 | 0.86 | RAB9A (0.57) | TDP1RAB9AHRH1CYP2D6KCNH2 | |
| SCHEMBL9539669 | 0.86 | RAB9A (0.52) | RAB9AHRH1CYP2D6KCNH2MAPT | |
| SCHEMBL10549525 | 0.86 | RAB9A (0.55) | RAB9AHRH1CYP2D6KCNH2MAPT | |
| SCHEMBL9539974 | 0.85 | KCNH2 (0.69) | RAB9AHRH1CYP2D6KCNH2MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0151826-B1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-31 | — | — | EP | claimed |