Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 6/20 | 0.39 |
| ▸ | MAOB | P27338 | 6/20 | 0.39 |
| ▸ | BRD4 | O60885 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SNRNP200 | O75643 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28354488 | 0.82 | MAOB (0.52) | ALDH1A1MAOAMAOB | |
| SCHEMBL28355136 | 0.81 | AHR (0.42) | ALDH1A1MAOAMAOBBRD4SNRNP200 | |
| SCHEMBL28354633 | 0.81 | BRD4 (0.49) | ALDH1A1MAOAMAOBBRD4TSHR | |
| SCHEMBL28354632 | 0.81 | SMN1; SMN2 (0.45) | ALDH1A1MAOAMAOBBRD4 | |
| SCHEMBL28358735 | 0.74 | CMA1 (0.42) | ALDH1A1MAOAMAOBSNRNP200 | |
| SCHEMBL28882918 | 0.69 | CDK5 (0.45) | ALDH1A1BRD4SNRNP200 | |
| SCHEMBL7349900 | 0.68 | AHR (0.53) | MAOB | |
| SCHEMBL28358561 | 0.68 | AHR (0.43) | ALDH1A1SNRNP200 | |
| SCHEMBL28358766 | 0.68 | ALDH1A1 (0.41) | ALDH1A1BRD4TSHRSNRNP200 | |
| SCHEMBL28358486 | 0.68 | ALDH1A1 (0.41) | ALDH1A1BRD4SNRNP200 |
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-106749045-B | D-amino acid oxidase inhibitor and preparation method and application thereof | 上海交通大学 | 2020-02-14 | — | — | CN | disclosed |