Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | RORB | Q92753 | 3/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.33 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.33 |
| ▸ | CCKBR | P32239 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | HNF4A | P41235 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28025572 | 0.80 | RORB (0.47) | RORBRORCPDK2 | |
| SCHEMBL28021807 | 0.77 | BCAT2 (0.59) | RORBRORCBCAT2PDK2NPC1 | |
| SCHEMBL3800244 | 0.69 | CYP2A6 (0.41) | PTPN1MEN1KMT2ACA12CA1 | |
| SCHEMBL28025019 | 0.69 | RORB (0.42) | RORBRORCCA12CA9 | |
| SCHEMBL5345150 | 0.69 | HPGD (0.52) | PTPN1P2RX1MEN1KMT2ANPC1 | |
| SCHEMBL17454801 | 0.68 | MYC (0.41) | KMT2A | |
| SCHEMBL28821428 | 0.68 | SLC9A1 (0.42) | RORBRORCCA12CA9 | |
| SCHEMBL29974068 | 0.67 | KDM4E (0.56) | PTPN1MEN1KMT2ATDP1SMN1; SMN2 | |
| SCHEMBL11305092 | 0.67 | CYP2A6 (0.54) | MEN1KMT2APDK2NPC1RAB9A | |
| SCHEMBL17454748 | 0.66 | NR1H4 (0.49) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104788333-B | 2-substituted-9,10-anthraquinone compounds, and preparation method and application thereof | 中国医科大学 | 2017-03-22 | — | — | CN | disclosed |