Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.49 |
| ▸ | QDPR | P09417 | 4/20 | 0.36 |
| ▸ | FASN | P49327 | 1/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.32 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.32 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL16188911 | 0.88 | ESR2 (0.47) | ESR2FASNHRH3 | |
| SCHEMBL2394485 | 0.83 | ESR2 (0.36) | ESR2QDPR | |
| SCHEMBL30817700 | 0.83 | ESR2 (0.36) | ESR2QDPR | |
| SCHEMBL8932666 | 0.81 | QDPR (0.33) | ESR2QDPR | |
| SCHEMBL9979948 | 0.80 | ESR2 (0.52) | ESR2FASNUSP30 | |
| SCHEMBL2392780 | 0.80 | CYP2C9 (0.49) | ESR2PANK3 | |
| SCHEMBL6558027 | 0.80 | CYP2C9 (0.49) | ESR2PANK3 | |
| SCHEMBL30400657 | 0.80 | CYP2C9 (0.49) | ESR2PANK3 | |
| SCHEMBL21237804 | 0.79 | ESR2 (0.56) | ESR2QDPRFASN | |
| SCHEMBL8222400 | 0.79 | CYP2C9 (0.48) | ESR2PANK3 |
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-2441743-B1 | Method for manufacturing aromatic compounds | MERCK PATENT GMBH (DE) | 2013-08-21 | — | — | EP | disclosed |
| EP-2441743-A1 | Method for manufacturing aromatic compounds | Merck Patent GmbH (DE) | 2012-04-18 | — | — | EP | disclosed |