Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 12/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL5507033 | 0.88 | HRH3 (0.42) | HRH3 | |
| SCHEMBL5502174 | 0.87 | HRH3 (0.44) | HRH3 | |
| SCHEMBL5508033 | 0.87 | HRH3 (0.42) | HRH3 | |
| SCHEMBL5508273 | 0.86 | HRH3 (0.37) | HRH3CYP2D6 | |
| SCHEMBL5506014 | 0.84 | HRH3 (0.47) | HRH3CYP1A2CYP2D6KCNH2KEAP1 | |
| SCHEMBL5502752 | 0.84 | CXCR4 (0.47) | HRH3CHRM2CHRM1 | |
| SCHEMBL5506424 | 0.84 | HRH3 (0.41) | HRH3 | |
| SCHEMBL5505798 | 0.84 | HRH3 (0.41) | HRH3 | |
| SCHEMBL5506775 | 0.84 | CXCR4 (0.47) | HRH3CHRM2CHRM1 | |
| SCHEMBL5505523 | 0.84 | HRH3 (0.41) | HRH3 |
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-1847530-A1 | DIAMINE DERIVATIVE | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2007-10-24 | — | — | EP | disclosed |