Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.44 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | STK39 | Q9UEW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28877412 | 0.87 | KMT2A (0.55) | GAAHTTBCAT2ALDH1A1RECQL | |
| SCHEMBL30032552 | 0.83 | FFAR1 (0.53) | HSD17B10BCAT2ALDH1A1KDM4EKMT2A | |
| SCHEMBL23796663 | 0.83 | FFAR1 (0.53) | HSD17B10BCAT2ALDH1A1KDM4EKMT2A | |
| SCHEMBL30031313 | 0.82 | BCAT2 (0.48) | GAAHSD17B10BCAT2KDM4EKMT2A | |
| SCHEMBL23796759 | 0.82 | BCAT2 (0.48) | GAAHSD17B10BCAT2KDM4EKMT2A | |
| SCHEMBL28877417 | 0.81 | NR1H4 (0.49) | GAAHTTTSHRHSD17B10BCAT2 | |
| SCHEMBL28877452 | 0.80 | TOP1 (0.43) | GAATSHRHSD17B10ALDH1A1MAPT | |
| SCHEMBL23796725 | 0.79 | BCL2 (0.46) | HTTBCAT2ALDH1A1MAPTKDM4E | |
| SCHEMBL30031784 | 0.79 | BCL2 (0.46) | HTTBCAT2ALDH1A1MAPTKDM4E | |
| SCHEMBL23796797 | 0.79 | BCAT2 (0.43) | TSHRHSD17B10BCAT2ALDH1A1MAPT |
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-115279730-A | 2, 5-or 2, 6-disubstituted hydroquinone derivatives having at least one carboxyl, sulfo or amido group useful as medicaments | OM药物公司 | 2022-11-01 | — | — | CN | claimed |