Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 6/20 | 0.35 |
| ▸ | MAOB | P27338 | 6/20 | 0.35 |
| ▸ | ANPEP | P15144 | 6/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | AOC2 | O75106 | 5/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28904739 | 0.77 | CA2 (0.37) | MAOAMAOBANPEPTSHRALDH1A1 | |
| SCHEMBL11286717 | 0.74 | CES2 (0.43) | MAOAMAOB | |
| SCHEMBL2424577 | 0.72 | TSHR (0.48) | MAOAMAOBANPEPTSHR | |
| SCHEMBL1782335 | 0.69 | MAOB (0.41) | MAOAMAOBANPEPTSHRAOC2 | |
| SCHEMBL1783171 | 0.68 | MAOB (0.43) | MAOAMAOBANPEPTSHRHPGD | |
| SCHEMBL7664111 | 0.68 | MAOB (0.43) | MAOAMAOBANPEPTSHRHPGD | |
| SCHEMBL8496949 | 0.68 | MAOB (0.39) | MAOAMAOBANPEPTSHRHPGD | |
| SCHEMBL8823819 | 0.68 | MAOB (0.39) | MAOAMAOBANPEPTSHRALDH1A1 | |
| SCHEMBL28352710 | 0.67 | ALDH1A1 (0.45) | TSHRALDH1A1HPGD | |
| SCHEMBL20525259 | 0.67 | MAOA (0.38) | MAOAMAOBANPEPTSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1105989-A | Tricyclic 1-aminoethylpyrrol derivative | HOFFMANN LA ROCHE (CH) | 1995-08-02 | — | — | CN | disclosed |