Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.51 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.46 |
| ▸ | DRD2 | P14416 | 3/20 | 0.46 |
| ▸ | DRD4 | P21917 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
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 SCHEMBL7324349 | 0.78 | HRH3 (0.74) | KCNH2HRH3CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9387229 | 0.78 | SIGMAR1 (0.64) | KCNH2HRH3GNAO1CHRM1CHRM2 | |
| SCHEMBL8521050 | 0.77 | KCNH2 (0.48) | KCNH2DRD2HRH1CCR3 | |
| Ammonia Solution, Strong SCHEMBL27868061 | 0.75 | LIPG (0.53) | KCNH2 | |
| Bromide SCHEMBL9388149 | 0.75 | MAOA (0.60) | KCNH2HRH3GNAO1CHRM1CHRM2 | |
| SCHEMBL25444591 | 0.75 | GNAO1 (0.70) | KCNH2HRH3GNAO1CHRM1CHRM2 | |
| SCHEMBL28332333 | 0.75 | LIPG (0.52) | ALDH1A1 | |
| SCHEMBL25121970 | 0.75 | GNAO1 (0.70) | KCNH2HRH3GNAO1CHRM1CHRM2 | |
| Cyanide SCHEMBL30212624 | 0.74 | GNAO1 (0.64) | KCNH2HRH3GNAO1CHRM1CHRM2 | |
| Cyanide SCHEMBL30212746 | 0.74 | GNAO1 (0.64) | KCNH2HRH3GNAO1CHRM1CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1994001403-A1 | PIPERIDINE DERIVATIVES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1994-01-20 | — | — | WO | disclosed |