Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 2/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25528080 | 1.00 | ALDH1A1 (0.33) | ALDH1A1POLBSMN1; SMN2ERN1DRD2 | |
| SCHEMBL25528081 | 0.85 | ALDH1A1 (0.36) | ALDH1A1POLBSMN1; SMN2ERN1DRD2 | |
| SCHEMBL28610902 | 0.85 | ALDH1A1 (0.36) | ALDH1A1POLBSMN1; SMN2ERN1DRD2 | |
| SCHEMBL28619049 | 0.85 | ALDH1A1 (0.36) | ALDH1A1POLBSMN1; SMN2ERN1DRD2 | |
| SCHEMBL28920931 | 0.79 | ALDH1A1 (0.35) | ALDH1A1POLBSMN1; SMN2ERN1DRD2 | |
| SCHEMBL25528083 | 0.77 | ALDH1A1 (0.37) | ALDH1A1POLBSMN1; SMN2ERN1DRD2 | |
| SCHEMBL4836868 | 0.75 | ALDH1A1 (0.37) | ALDH1A1POLBSMN1; SMN2DRD2DRD4 | |
| SCHEMBL21893556 | 0.71 | KEAP1 (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL24656010 | 0.70 | — | — | |
| SCHEMBL28623253 | 0.70 | KEAP1 (0.40) | ALDH1A1SMN1; SMN2 |
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-113164459-A | Monoacylglycerol lipase modulators | 詹森药业有限公司 | 2021-07-23 | — | — | CN | claimed |