Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 16/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5703853 | 0.86 | KDM4E (0.46) | SCN9ASCN5AGRM2ADRB1ADRB3 | |
| SCHEMBL4582967 | 0.81 | SCN9A (0.43) | SCN9ASCN5AGRM2ADRB1ADRB3 | |
| SCHEMBL5703690 | 0.80 | ADRB3 (0.46) | SCN9AADRB1ADRB3ALDH1A1TP53 | |
| SCHEMBL5703997 | 0.75 | SCN9A (0.55) | SCN9AADRB1ADRB3 | |
| SCHEMBL22444820 | 0.70 | CXCR2 (0.50) | SCN9AADRB1ADRB3ALDH1A1TP53 | |
| SCHEMBL22067283 | 0.69 | KCNMA1 (0.48) | SCN9AADRB1ADRB3 | |
| SCHEMBL7991086 | 0.69 | ALDH1A1 (0.56) | GRM2ADRB1ADRB3ALDH1A1TP53 | |
| SCHEMBL4585857 | 0.68 | KDM4E (0.44) | SCN9AADRB1ADRB3 | |
| SCHEMBL4584315 | 0.66 | ADRB1 (0.42) | SCN9ASCN5AGRM2ADRB1ADRB3 | |
| SCHEMBL16319476 | 0.65 | SCN9A (0.59) | SCN9ASCN5A |
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-1697301-A2 | AMINOALCOHOL DERIVATIVES | Astellas Pharma Inc. (JP) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005061433-A2 | AMINOALCOHOL DERIVATIVES | ASTELLAS PHARMA INC. (JP) | 2005-07-07 | — | — | WO | disclosed |