Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10032995 | 0.87 | HTR2A (0.34) | BCHEACHECCR5HTR2AHTR2C | |
| SCHEMBL1709436 | 0.83 | KDM4E (0.33) | ACHEHTR2C | |
| SCHEMBL10033181 | 0.83 | KDM4E (0.33) | ACHEHTR2C | |
| SCHEMBL1709356 | 0.81 | BCHE (0.35) | BCHE | |
| SCHEMBL10033105 | 0.80 | TDP1 (0.36) | CCR5OPRM1OPRD1 | |
| SCHEMBL10032983 | 0.79 | KDM4E (0.32) | — | |
| SCHEMBL1709440 | 0.79 | KDM4E (0.32) | — | |
| SCHEMBL10032973 | 0.79 | SIGMAR1 (0.38) | HTR2C | |
| SCHEMBL10033085 | 0.78 | HTR2A (0.40) | BCHEACHEHTR2AHTR2CHTR2B | |
| SCHEMBL10033111 | 0.78 | HTR2C (0.35) | HTR2AHTR2CHTR2B |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |