Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 6/20 | 0.47 |
| ▸ | MME | P08473 | 1/20 | 0.47 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 5/20 | 0.39 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20122438 | 1.00 | ACE (0.47) | ACEMMEACE2PPARGPPARA | |
| SCHEMBL18650319 | 0.85 | PAM (0.41) | PPARGPPARAPPARDTP53TSHR | |
| SCHEMBL18650304 | 0.85 | PAM (0.41) | PPARGPPARAPPARDTP53TSHR | |
| SCHEMBL20122588 | 0.83 | ACE (0.48) | ACEMMEACE2PPARGPPARA | |
| SCHEMBL20122573 | 0.83 | ACE (0.40) | ACEMMEACE2SMN1; SMN2 | |
| SCHEMBL20122442 | 0.83 | ACE (0.40) | ACEMMEACE2SMN1; SMN2 | |
| SCHEMBL20122577 | 0.82 | ACE (0.39) | ACEMMEACE2 | |
| SCHEMBL20122575 | 0.82 | ACE (0.39) | ACEMMEACE2 | |
| SCHEMBL20122440 | 0.82 | ACE (0.39) | ACEMMEACE2 | |
| SCHEMBL20122439 | 0.81 | ACE (0.38) | ACEMMEACE2 |
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 |