Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | GFER | P55789 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL19305858 | 0.88 | HTT (0.55) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL6671752 | 0.83 | HTT (0.65) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL28060973 | 0.82 | MEN1 (0.73) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL14539624 | 0.82 | HTT (0.59) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL27624091 | 0.81 | HTT (0.57) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL666963 | 0.81 | HTT (0.57) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL966694 | 0.80 | MEN1 (0.69) | HTTCYP2C19CYP3A4CYP2C9MEN1 | |
| SCHEMBL2485280 | 0.78 | MKNK1 (0.43) | HTTCYP3A4NPSR1MAPTGFER | |
| SCHEMBL4670467 | 0.77 | HTT (0.54) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL12978259 | 0.75 | HTT (0.66) | HTTCYP2C19CYP3A4CYP2C9CYP2B6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023116390-A1 | PYRIMIDINE-2(1H)-ONE-FUSED BICYCLIC COMPOUND HAVING MAT2A INHIBITORY ACTIVITY AND USE THEREOF | 上海海和药物研究开发股份有限公司 | 2023-06-29 | — | — | WO | disclosed |