Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 2/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.36 |
| ▸ | SCD | O00767 | 3/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | DRD1 | P21728 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | FADS1 | O60427 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| SCHEMBL5907425 | 0.90 | CHRM2 (0.43) | ALDH1A1MAP4K1HTR2BHTR1AHTR7 | |
| SCHEMBL5228640 | 0.87 | HTR2B (0.39) | MAP4K1HTR2BHTR1AHTR7HTR3A | |
| SCHEMBL7261976 | 0.85 | HTR1A (0.42) | ALDH1A1HTR2BHTR1AHTR7HTR3A | |
| SCHEMBL5224222 | 0.85 | MAP4K1 (0.39) | ALDH1A1MAP4K1HTR2BHTR1AHTR7 | |
| SCHEMBL5232124 | 0.85 | HTR1A (0.38) | ALDH1A1MAP4K1HTR2BHTR1AHTR7 | |
| SCHEMBL2761086 | 0.85 | HTR2B (0.39) | MAP4K1HTR2BHTR1AHTR7HTR3A | |
| SCHEMBL5226498 | 0.83 | HTR1A (0.38) | ALDH1A1MAP4K1HTR2BHTR1AHTR7 | |
| SCHEMBL5224931 | 0.83 | EPHB4 (0.41) | MAP4K1HTR2BHTR1AHTR7HTR3A | |
| SCHEMBL2761056 | 0.83 | ALDH1A1 (0.43) | ALDH1A1MAP4K1HTR2BHTR1AHTR7 | |
| SCHEMBL7261175 | 0.82 | HTR2B (0.40) | HTR2BHTR1AHTR7HTR3AHTR6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1817306-A1 | TRIAZOLES AND THEIR USE AS BRADYKININ B1 RECEPTOR ANTAGONISTS | Amgen, Inc (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006044355-A1 | TRIAZOLES AND THEIR USE AS BRADYKININ B1 RECEPTOR ANTAGONISTS | AMGEN INC. (US) | 2006-04-27 | — | — | WO | disclosed |