Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17427727 | 0.73 | GRM5 (0.33) | — | |
| SCHEMBL23775721 | 0.73 | HPGD (0.33) | KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL27419191 | 0.72 | — | — | |
| SCHEMBL84582 | 0.71 | GRM5 (0.50) | ALDH1A1HSD17B10 | |
| SCHEMBL16941383 | 0.70 | BRD4 (0.39) | ALDH1A1HPGD | |
| SCHEMBL20803906 | 0.69 | GRM5 (0.42) | — | |
| SCHEMBL27419152 | 0.69 | CHRNB2 (0.34) | — | |
| SCHEMBL21284303 | 0.68 | — | — | |
| SCHEMBL21317486 | 0.68 | — | — | |
| SCHEMBL21311499 | 0.68 | — | — |
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-2021160132-A1 | HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海美悦生物科技发展有限公司 | 2021-08-19 | — | — | WO | disclosed |