Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16468096 | 1.00 | THRB (0.40) | THRBCYP2C19TDP1GPR84ALDH1A1 | |
| SCHEMBL2775806 | 0.80 | CYP2C19 (0.44) | CYP2C19TDP1ALDH1A1 | |
| SCHEMBL16690276 | 0.78 | THRB (0.46) | THRBGPR84 | |
| SCHEMBL18782546 | 0.78 | THRB (0.46) | THRBGPR84 | |
| SCHEMBL391722 | 0.76 | THRB (0.39) | THRBTDP1GPR84ALDH1A1 | |
| SCHEMBL5107560 | 0.76 | THRB (0.39) | THRBTDP1GPR84ALDH1A1 | |
| SCHEMBL27768581 | 0.74 | THRB (0.42) | THRB | |
| SCHEMBL20530462 | 0.73 | — | — | |
| SCHEMBL20530464 | 0.73 | — | — | |
| SCHEMBL14860212 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1778213-A2 | OLIGOMERIC COMPOUNDS | KETOCYTONYX INC. (US) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006020137-A2 | OLIGOMERIC COMPOUNDS | KETOCYTONYX INC. (US) | 2006-02-23 | — | — | WO | disclosed |