Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12953138 | 0.98 | ALDH1A1 (0.41) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1014859 | 0.89 | KDM4E (0.50) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1016088 | 0.88 | HRH3 (0.50) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL12953209 | 0.88 | HRH3 (0.42) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1017253 | 0.88 | HTT (0.49) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1020498 | 0.88 | NAMPT (0.43) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1018400 | 0.88 | ALDH1A1 (0.47) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1019727 | 0.87 | HTT (0.44) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1017697 | 0.87 | HRH3 (0.41) | HRH3KCNH2ALDH1A1KDM4EPKM | |
| SCHEMBL1018217 | 0.87 | ALDH1A1 (0.46) | HRH3KCNH2ALDH1A1KDM4EPKM |
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-2007106349-A2 | PIPERAZINYL OXOALKYL TETRAHYDROISOQUINOLINES AND RELATED ANALOGUES | NEUROGEN CORPORATION (US) | 2007-09-20 | — | — | WO | disclosed |