Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | WNT3A | P56704 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24802459 | 0.87 | MEN1 (0.45) | SLC13A5POLBMEN1KMT2AALDH1A1 | |
| SCHEMBL30148721 | 0.84 | HSD17B10 (0.47) | HSD17B10POLBMEN1KMT2AALDH1A1 | |
| SCHEMBL3873628 | 0.83 | POLB (0.49) | HSD17B10POLBMEN1KMT2AALDH1A1 | |
| SCHEMBL24802582 | 0.83 | POLB (0.63) | HSD17B10POLBMEN1KMT2AALDH1A1 | |
| SCHEMBL13205866 | 0.81 | HSD17B10 (0.70) | MAPK8HSD17B10SLC13A5ALDH1A1ACHE | |
| SCHEMBL29773177 | 0.81 | HSD17B10 (0.70) | MAPK8HSD17B10SLC13A5ALDH1A1ACHE | |
| Hydrochloric Acid SCHEMBL30772166 | 0.81 | GAA (0.47) | HSD17B10POLBMEN1KMT2AALDH1A1 | |
| SCHEMBL30148642 | 0.81 | HSD17B10 (0.46) | HSD17B10POLBMEN1KMT2AALDH1A1 | |
| SCHEMBL23616869 | 0.81 | MAPK8 (0.48) | MAPK8HSD17B10SLC13A5MEN1KMT2A | |
| SCHEMBL24802505 | 0.80 | HSD17B10 (0.44) | HSD17B10POLBMEN1KMT2AALDH1A1 |
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-2022268209-A1 | DERIVATIVE HAVING PYRIMIDINE-FUSED CYCLIC STRUCTURE, AND USE THEREOF | 四川汇宇制药股份有限公司 | 2022-12-29 | — | — | WO | disclosed |