Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 2/20 | 0.44 |
| ▸ | DRD4 | P21917 | 3/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 3/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | 0.88 | HRH3 (0.48) | HTR7BACE1HRH3HTR1AKCNH2 | |
| SCHEMBL8315438 | 0.85 | KCNH2 (0.43) | ABCB1ABCC1DRD4DRD3DRD2 | |
| SCHEMBL8314770 | 0.84 | CHRM1 (0.40) | HTR7HRH3HTR1ACHRM3SLC6A3 | |
| SCHEMBL8317603 | 0.82 | HRH3 (0.40) | DRD3BACE1HRH3SIGMAR1 | |
| SCHEMBL8316880 | 0.78 | HRH3 (0.39) | HTR7DRD3DRD2HRH3HTR1A | |
| SCHEMBL8316992 | 0.78 | HRH3 (0.39) | HTR7DRD4DRD3DRD2HRH3 | |
| SCHEMBL8312305 | 0.77 | MC4R (0.39) | BACE1HRH3CHRM3KCNH2ALDH1A1 | |
| SCHEMBL8316497 | 0.75 | MC4R (0.39) | DRD3DRD2HRH3ADRA1DADRA1A | |
| SCHEMBL11037599 | 0.69 | HTR7 (0.41) | HTR7DRD3DRD2BACE1HRH3 | |
| Hydrochloric Acid SCHEMBL11034929 | 0.69 | HTR7 (0.41) | HTR7DRD3DRD2BACE1HRH3 |
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 |