Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | SSTR5 | P35346 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.52 |
| ▸ | HRH1 | P35367 | 7/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.52 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9536543 | 0.90 | SSTR5 (0.66) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| SCHEMBL9536663 | 0.87 | RAB9A (0.55) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| Hydrochloric Acid SCHEMBL9537670 | 0.87 | RAB9A (0.55) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| SCHEMBL9537554 | 0.87 | HRH1 (0.63) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| SCHEMBL9536935 | 0.86 | NPSR1 (0.55) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| Hydrochloric Acid SCHEMBL9539517 | 0.86 | HRH1 (0.62) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| Hydrochloric Acid SCHEMBL9537718 | 0.85 | TP53 (0.52) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| SCHEMBL9539669 | 0.85 | RAB9A (0.52) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| SCHEMBL9537249 | 0.85 | SCN9A (0.53) | RAB9ASSTR5CYP2D6HRH1KCNH2 | |
| SCHEMBL9537151 | 0.85 | SSTR5 (0.59) | RAB9ASSTR5CYP2D6HRH1KCNH2 |
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 | disclosed |