Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | PTPRB | P23467 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CTSS | P25774 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1111032 | 0.86 | CTSK (0.36) | CA12CA1CA2CA14CA7 | |
| SCHEMBL7674935 | 0.73 | DGAT1 (0.43) | DGAT1CA12CA1CA2HTT | |
| SCHEMBL11143316 | 0.71 | PPARD (0.34) | DGAT1CA12CA1CA2TDP1 | |
| SCHEMBL14819108 | 0.71 | CA1 (0.39) | CA12CA1CA2CA14CA7 | |
| SCHEMBL1852632 | 0.70 | MEN1 (0.37) | DGAT1CA12CA1CA2CA14 | |
| SCHEMBL28682014 | 0.69 | DGAT1 (0.45) | DGAT1PTPRBCA12CA1CA2 | |
| SCHEMBL29383045 | 0.69 | DGAT1 (0.45) | DGAT1PTPRBCA12CA1CA2 | |
| SCHEMBL4792294 | 0.69 | DGAT1 (0.45) | DGAT1PTPRBCA12CA1CA2 | |
| SCHEMBL28682013 | 0.69 | DGAT1 (0.45) | DGAT1PTPRBCA12CA1CA2 | |
| SCHEMBL88463 | 0.69 | DGAT1 (0.45) | DGAT1PTPRBCA12CA1CA2 |
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-2225253-A1 | PHOSPHONIC ACID DERIVATES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS | Actelion Pharmaceuticals Ltd. (CH) | 2010-09-08 | — | — | EP | disclosed |
| WO-2009069100-A1 | PHOSPHONIC ACID DERIVATES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2009-06-04 | — | — | WO | disclosed |