Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | PKLR | P30613 | 1/20 | 0.47 |
| ▸ | GBA1 | P04062 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1886298 | 1.00 | HTT (0.54) | HTTNR1H4GAALMNAPKM | |
| SCHEMBL29880670 | 0.88 | NR1H4 (0.59) | NR1H4LMNAPKMPKLRUSP2 | |
| SCHEMBL1893687 | 0.88 | NR1H4 (0.59) | NR1H4LMNAPKMPKLRUSP2 | |
| SCHEMBL29880959 | 0.87 | NR1H4 (0.59) | HTTNR1H4GAALMNAPKM | |
| SCHEMBL1885228 | 0.87 | NR1H4 (0.59) | HTTNR1H4GAALMNAPKM | |
| SCHEMBL1881182 | 0.86 | NR1H4 (0.61) | NR1H4LMNAGBA1MAPTHPGD | |
| SCHEMBL29880988 | 0.86 | NR1H4 (0.61) | NR1H4LMNAGBA1MAPTHPGD | |
| SCHEMBL1886342 | 0.84 | POLB (0.49) | HTTNR1H4GAALMNAMAPT | |
| SCHEMBL1883290 | 0.83 | NR1H4 (0.56) | NR1H4GAALMNAPKMPKLR | |
| SCHEMBL29880880 | 0.83 | NR1H4 (0.56) | NR1H4GAALMNAPKMPKLR |
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-110404073-B | Methods and pharmaceutical compositions for treating hepatitis B virus infection | 国家医疗保健研究所 | 2022-08-16 | — | — | CN | disclosed |