Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 4/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | PTPN7 | P35236 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL29323993 | 0.75 | HMGCR (0.35) | HMGCRPTGS2PTPN7TDP1RECQL | |
| SCHEMBL10901811 | 0.73 | HMGCR (0.43) | HMGCRPTPN7TDP1RECQLALDH1A1 | |
| SCHEMBL4940667 | 0.72 | TSHR (0.33) | HMGCRTSHR | |
| SCHEMBL11286065 | 0.71 | TSHR (0.40) | HMGCRPTGS2PTPN7TDP1RECQL | |
| Bicarbonate SCHEMBL30883177 | 0.69 | HMGCR (0.43) | HMGCRPTGS2PTPN7TDP1RECQL | |
| SCHEMBL9300762 | 0.69 | — | — | |
| SCHEMBL30088546 | 0.68 | PTPN7 (0.48) | HMGCRPTPN7TDP1RECQLALDH1A1 | |
| SCHEMBL9547952 | 0.68 | — | — | |
| SCHEMBL10900390 | 0.68 | HMGCR (0.46) | HMGCRPTGS2PTPN7TDP1RECQL | |
| SCHEMBL17260751 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019180105-A1 | MITOCHONDRIAL PH PROBE | ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) | 2019-09-26 | — | — | WO | disclosed |
| EP-3543705-A1 | MITOCHONDRIAL PH PROBE | ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) | 2019-09-25 | — | — | EP | disclosed |