Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 2/20 | 0.44 |
| ▸ | MME | P08473 | 1/20 | 0.44 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 9/20 | 0.39 |
| ▸ | PPARA | Q07869 | 9/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | FOLH1 | Q04609 | 4/20 | 0.34 |
| ▸ | RIMKLA | Q8IXN7 | 1/20 | 0.34 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7860189 | 0.83 | PPARA (0.53) | ACEPPARGPPARAPPARDCYP1A2 | |
| SCHEMBL8582258 | 0.83 | MAPT (0.44) | PPARGPPARAPPARDCYP1A2CYP2C9 | |
| SCHEMBL2082970 | 0.83 | PPARA (0.53) | ACEPPARGPPARAPPARDCYP1A2 | |
| SCHEMBL20122455 | 0.81 | ACE (0.48) | ACEMMEACE2FOLH1RIMKLA | |
| SCHEMBL20122586 | 0.81 | ACE (0.40) | ACEMMEACE2FOLH1RIMKLA | |
| SCHEMBL11198946 | 0.80 | ACE (0.47) | ACEMMEACE2PPARGPPARA | |
| SCHEMBL20122463 | 0.80 | ACE (0.40) | ACEMMEACE2FOLH1RIMKLA | |
| SCHEMBL20122442 | 0.80 | ACE (0.40) | ACEMMEACE2FOLH1RIMKLA | |
| SCHEMBL20122573 | 0.80 | ACE (0.40) | ACEMMEACE2FOLH1RIMKLA | |
| SCHEMBL20122587 | 0.80 | ACE (0.40) | ACEMMEACE2FOLH1RIMKLA |
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-9963428-B1 | Bucillamine prodrugs, pharmaceutical compositions thereof, and methods of use | Nguyen, Mark Quang (US) | 2018-05-08 | — | — | US | disclosed |