Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 6/20 | 0.42 |
| ▸ | HTR2A | P28223 | 7/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14150341 | 0.90 | FFAR1 (0.46) | AOC3FFAR1GPR84ALDH1A1LMNA | |
| SCHEMBL11706315 | 0.86 | HTR2A (0.45) | AOC3HRH1HTR2ATAAR1ALDH1A1 | |
| SCHEMBL10492512 | 0.82 | AOC3 (0.39) | AOC3HRH1HTR2ATAAR1SLC6A4 | |
| SCHEMBL10693139 | 0.81 | CYP19A1 (0.42) | AOC3HRH1HTR2ASLC6A4FFAR1 | |
| SCHEMBL107889 | 0.79 | HRH1 (0.56) | AOC3HRH1HTR2ATAAR1SLC6A4 | |
| SCHEMBL9227440 | 0.78 | CYP19A1 (0.50) | AOC3HRH1HTR2ASLC6A4FFAR1 | |
| SCHEMBL28122680 | 0.78 | ALDH1A1 (0.42) | AOC3FFAR1GPR84ALDH1A1CYP1A2 | |
| SCHEMBL11009762 | 0.78 | HTR2A (0.62) | HRH1HTR2ATAAR1SLC6A4CYP3A4 | |
| SCHEMBL27530643 | 0.78 | HRH1 (0.56) | AOC3HRH1HTR2ATAAR1SLC6A4 | |
| SCHEMBL1602038 | 0.77 | ALDH1A1 (0.45) | TAAR1SLC6A4GPR84ALDH1A1LMNA |
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-1998037084-A1 | 3-SUBSTITUTED CLAVAMS FOR CALPAIN INHIBITION | SMITHKLINE BEECHAM CORPORATION (US) | 1998-08-27 | — | — | WO | disclosed |