Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 3/20 | 0.39 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.37 |
| ▸ | PPARG | P37231 | 6/20 | 0.37 |
| ▸ | PPARD | Q03181 | 6/20 | 0.37 |
| ▸ | PPARA | Q07869 | 6/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.37 |
| ▸ | TLR2 | O60603 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | FABP4 | P15090 | 2/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1723999 | 1.00 | TSHR (0.40) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL1723834 | 1.00 | TSHR (0.40) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL1723964 | 0.97 | CES2 (0.36) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL11285135 | 0.90 | TSHR (0.44) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL1723586 | 0.90 | CES2 (0.33) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL6269075 | 0.90 | TSHR (0.44) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL11483342 | 0.90 | TSHR (0.44) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL6264699 | 0.90 | TSHR (0.44) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL9129618 | 0.90 | TSHR (0.44) | TSHRTHRBCES2CES1ALDH1A1 | |
| SCHEMBL1502042 | 0.87 | CES2 (0.39) | TSHRTHRBCES2CES1ALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1902004-B1 | ONIUM-ALKYLSULFONATE PRODUCTION METHOD | MERCK PATENT GMBH (DE) | 2012-01-18 | — | — | EP | disclosed |
| EP-1902004-A2 | ONIUM-ALKYLSULFONATE PRODUCTION METHOD | Merck Patent GmbH (DE) | 2008-03-26 | — | — | EP | disclosed |
| EP-1902035-A1 | METHOD FOR THE PRODUCTION OF ONIUM ALKYL SULFITES | Merck Patent GmbH (DE) | 2008-03-26 | — | — | EP | disclosed |
| WO-2007006389-A1 | MIXTURE OF ONIUM ALKYL SULFONATES AND ONIUM ALKYL SULFITES | MERCK PATENT GMBH (DE) | 2007-01-18 | — | — | WO | disclosed |
| WO-2007006388-A1 | METHOD FOR THE PRODUCTION OF ONIUM ALKYL SULFITES | MERCK PATENT GMBH (DE) | 2007-01-18 | — | — | WO | disclosed |
| WO-2007006387-A2 | ONIUM-ALKYLSULFONATE PRODUCTION METHOD | MERCK PATENT GMBH (DE) | 2007-01-18 | — | — | WO | disclosed |