Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | EBP | Q15125 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD4 | P21917 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | QPCT | Q16769 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8316861 | 0.86 | HRH3 (0.48) | KCNH2HRH3BACE1 | |
| SCHEMBL8312632 | 0.85 | ABCB1 (0.47) | KCNH2HRH3SIGMAR1TMEM97DRD2 | |
| SCHEMBL8317603 | 0.82 | HRH3 (0.40) | HRH3SIGMAR1DRD3BACE1 | |
| SCHEMBL8316880 | 0.81 | HRH3 (0.39) | HRH3SIGMAR1DRD2DRD3 | |
| SCHEMBL8314770 | 0.80 | CHRM1 (0.40) | KCNH2HRH3 | |
| SCHEMBL8316992 | 0.80 | HRH3 (0.39) | KCNH2HRH3DRD2DRD4DRD3 | |
| SCHEMBL8312305 | 0.79 | MC4R (0.39) | KCNH2HRH3BACE1 | |
| SCHEMBL8316497 | 0.77 | MC4R (0.39) | KCNH2HRH3DRD2DRD3 | |
| SCHEMBL10559968 | 0.75 | KCNH2 (0.49) | KCNH2HRH3SIGMAR1DRD2DRD4 | |
| Oxalic Acid SCHEMBL10558317 | 0.73 | ALDH1A1 (0.50) | KCNH2SIGMAR1DRD2DRD4DRD3 |
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-0536419-B1 | TRICYCLIC TRIAZOLE DERIVATIVES, PRODUCTION AND USE THEREOF | TORAY INDUSTRIES (JP) | 1999-10-13 | — | — | EP | disclosed |