Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 5/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21708618 | 0.86 | LMNA (0.37) | ALDH1A1TRPA1FAAHCNR1CNR2 | |
| SCHEMBL21708625 | 0.82 | LMNA (0.43) | ALDH1A1FAAHCNR1CNR2TDP1 | |
| SCHEMBL10525765 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL716434 | 0.78 | CHRM1 (0.39) | ALDH1A1FAAHCHRM1AKR1A1CHRM3 | |
| SCHEMBL3976804 | 0.78 | MGAM (0.38) | FAAHCNR1CNR2CHRM1AKR1A1 | |
| SCHEMBL28966490 | 0.76 | — | — | |
| SCHEMBL4300126 | 0.76 | — | — | |
| SCHEMBL27813387 | 0.76 | — | — | |
| SCHEMBL25718461 | 0.75 | ALDH1A1 (0.41) | ALDH1A1TRPA1FAAHCNR1CNR2 | |
| SCHEMBL3972639 | 0.75 | GAA (0.56) | ALDH1A1TRPA1FAAHCNR1CNR2 |
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-2504327-A1 | ORTHOESTER DERIVATIVES OF CROWN ETHERS AS CARRIERS FOR PHARMACEUTICAL AND DIAGNOSTIC COMPOSITIONS | ArisGen SA (CH) | 2012-10-03 | — | — | EP | disclosed |
| WO-2011064300-A1 | ORTHOESTER DERIVATIVES OF CROWN ETHERS AS CARRIERS FOR PHARMACEUTICAL AND DIAGNOSTIC COMPOSITIONS | ARISGEN SA (CH) | 2011-06-03 | — | — | WO | disclosed |