Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 3/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 8/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | PDE2A | O00408 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12263468 | 0.84 | LMNA (0.43) | TYRADRA2AADRA2BADRA2CESR1 | |
| SCHEMBL27798663 | 0.81 | ADRA2A (0.40) | TYRADRA2AADRA2BADRA2CESR1 | |
| SCHEMBL2427206 | 0.81 | PDE2A (0.56) | TYRADRA2AADRA2BADRA2CESR1 | |
| SCHEMBL2427205 | 0.81 | PDE2A (0.56) | TYRADRA2AADRA2BADRA2CESR1 | |
| SCHEMBL24989713 | 0.78 | TSHR (0.47) | TYRADRA2AADRA2BADRA2CESR1 | |
| SCHEMBL27754190 | 0.78 | PTGS1 (0.40) | TYRADRA2AADRA2BADRA2CESR1 | |
| SCHEMBL29890111 | 0.77 | ESR1 (0.42) | TYRADRA2AADRA2BADRA2CESR1 | |
| SCHEMBL25459623 | 0.77 | ESR1 (0.42) | TYRADRA2AADRA2BADRA2CESR1 | |
| Ammonia Solution, Strong SCHEMBL7989997 | 0.77 | CES2 (0.44) | PDE2A | |
| SCHEMBL16219361 | 0.76 | PTGS1 (0.52) | TYRADRA2B |
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 |
|---|---|---|---|---|---|---|---|
| US-6277851-B1 | ORALLY ADMINISTERED TRYPSIN-RELATED SERINE PROTEASE INHIBITORS; ANTICOAGULANTS | ADIR ET COMPAGNIE (FR) | 2001-08-21 | — | — | US | disclosed |