Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 3/20 | 0.48 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 4/20 | 0.45 |
| ▸ | PPARD | Q03181 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.41 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2927687 | 0.80 | ALDH1A1 (0.62) | MEN1KMT2AALDH1A1TSHRGAA | |
| SCHEMBL14850480 | 0.80 | ALDH1A1 (0.62) | MEN1KMT2AALDH1A1TSHRGAA | |
| SCHEMBL11309280 | 0.73 | CA9 (0.53) | CA9SCN2ACA12CA1CA2 | |
| SCHEMBL13871737 | 0.72 | KMT2A (0.58) | CA9SCN2ACA12CA1CA2 | |
| SCHEMBL11565884 | 0.70 | KMT2A (0.55) | CA9SCN2ACA12CA1CA2 | |
| SCHEMBL10979841 | 0.69 | APP (0.50) | MEN1KMT2AALDH1A1TSHRHPGD | |
| SCHEMBL28650967 | 0.69 | CA12 (0.50) | CA9CA12MEN1KMT2AALDH1A1 | |
| SCHEMBL4580181 | 0.69 | NR1H3 (0.62) | CA9SCN2ACA12CA1CA2 | |
| SCHEMBL9345529 | 0.69 | PTGS1 (0.44) | ALDH1A1TSHR | |
| SCHEMBL6751634 | 0.69 | ALDH1A1 (0.55) | MEN1KMT2AALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0077662-B1 | PREPARATION OF NITROARYLACETIC ACID ESTERS AND DERIVATIVES THEREOF | ETHYL CORPORATION (US) | 1985-10-02 | — | — | EP | claimed |