Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 4/20 | 0.42 |
| ▸ | PPM1A | P35813 | 1/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL4733314 | 0.74 | RAD52 (0.44) | NPC1RAB9ALMNATP53CYP1A2 | |
| SCHEMBL11182451 | 0.74 | ALDH1A1 (0.41) | GAASLC6A2SLC6A3SLC6A4KIF11 | |
| SCHEMBL29756225 | 0.74 | NOX1 (0.38) | LMNABLMPIM1 | |
| Ammonia Solution, Strong SCHEMBL2438706 | 0.72 | GPR3 (0.46) | GPR3CES1NPC1RAB9AGMNN | |
| SCHEMBL4733543 | 0.69 | GPR3 (0.40) | GPR3PPM1ATRPV4CES1TRPA1 | |
| SCHEMBL4733537 | 0.69 | GPR3 (0.40) | GPR3PPM1ATRPV4CES1TRPA1 | |
| SCHEMBL20014448 | 0.69 | GPR3 (0.36) | GPR3CES1NPC1RAB9AGMNN | |
| SCHEMBL5905690 | 0.69 | KMT2A (0.59) | GPR3CES1LMNAGAABLM | |
| SCHEMBL11346578 | 0.66 | MAPK14 (0.43) | NPC1RAB9ALMNA | |
| SCHEMBL5535809 | 0.66 | NOX1 (0.35) | — |
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-2008061029-A1 | ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE | WYETH (US) | 2008-05-22 | — | — | WO | disclosed |