Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.40 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 6/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5864419 | 0.95 | POLB (0.44) | POLBRAB9ACYP2D6HRH1TP53 | |
| SCHEMBL5864471 | 0.92 | GAA (0.46) | POLBRAB9ACYP2D6HRH1TP53 | |
| SCHEMBL5864747 | 0.88 | ALDH1A1 (0.40) | POLBALDH1A1TDP1AGTR1AGTR2 | |
| SCHEMBL5864345 | 0.88 | POLB (0.44) | POLBALDH1A1TDP1RAB9AAGTR1 | |
| SCHEMBL5864422 | 0.83 | POLB (0.46) | POLBRAB9ACYP2D6HRH1TP53 | |
| SCHEMBL5864485 | 0.80 | AGTR1 (0.53) | ALDH1A1TDP1AGTR1AGTR2PPARG | |
| SCHEMBL5864477 | 0.80 | GAA (0.48) | POLBALDH1A1RAB9ACYP2D6HRH1 | |
| SCHEMBL5864750 | 0.78 | ALDH1A1 (0.40) | POLBALDH1A1TDP1AGTR1AGTR2 | |
| SCHEMBL5864499 | 0.77 | POLB (0.45) | POLBAGTR1AGTR2PPARG | |
| SCHEMBL5864496 | 0.70 | PPARG (0.44) | POLBAGTR1AGTR2PPARG |
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 |
|---|---|---|---|---|---|---|---|
| US-6984642-B1 | Substituted phenylcyclohexane carboxylic acid amides and their use as adenosine uptake inhibitors | BAYER AKTIENGESELLSCHAFT (DE) | 2006-01-10 | — | — | US | disclosed |
| EP-1187812-B1 | SUBSTITUTED PHENYLCYCLOHEXANE CARBOXYLIC ACID AMIDES AND THEIR USE AS ADENOSINE UPTAKE INHIBITORS | BAYER HEALTHCARE AG (DE) | 2005-09-07 | — | — | EP | disclosed |