Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1891845 | 1.00 | NR1H4 (0.64) | NR1H4TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL29881035 | 0.92 | NR1H4 (0.66) | NR1H4TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL29880947 | 0.92 | NR1H4 (0.63) | NR1H4TSHRALDH1A1KDM4EGAA | |
| SCHEMBL1894860 | 0.92 | NR1H4 (0.66) | NR1H4TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL1883857 | 0.92 | NR1H4 (0.63) | NR1H4TSHRALDH1A1KDM4EGAA | |
| SCHEMBL29880659 | 0.89 | NR1H4 (0.80) | NR1H4TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL1894116 | 0.89 | NR1H4 (0.80) | NR1H4TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL1892800 | 0.89 | NR1H4 (0.80) | NR1H4TSHRALDH1A1KDM4EGAA | |
| SCHEMBL1883064 | 0.89 | NR1H4 (0.62) | NR1H4TSHRALDH1A1LMNAKDM4E | |
| SCHEMBL29881852 | 0.89 | NR1H4 (0.59) | NR1H4ALDH1A1LMNAGAAMAPT |
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 |