Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | L3MBTL3 | Q96JM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL16063078 | 0.97 | CYP1A2 (0.46) | CYP1A2ALDH1A1L3MBTL1CHRM2 | |
| SCHEMBL17888212 | 0.97 | ALDH1A1 (0.45) | CYP1A2ALDH1A1L3MBTL1CHRM2CHRNB2 | |
| SCHEMBL16063087 | 0.97 | CYP1A2 (0.46) | CYP1A2ALDH1A1L3MBTL1CHRM2 | |
| SCHEMBL3436941 | 0.94 | ALDH1A1 (0.46) | CYP1A2ALDH1A1L3MBTL1CHRM2 | |
| SCHEMBL20384062 | 0.91 | CHRM2 (0.45) | ALDH1A1L3MBTL1CHRM2CHRNB2CHRNB4 | |
| SCHEMBL2274269 | 0.91 | CHRM2 (0.45) | ALDH1A1L3MBTL1CHRM2CHRNB2CHRNB4 | |
| SCHEMBL20939371 | 0.86 | CHRM2 (0.47) | ALDH1A1L3MBTL1CHRM2CHRNB2CHRNB4 | |
| SCHEMBL19992145 | 0.86 | CHRM2 (0.47) | ALDH1A1L3MBTL1CHRM2CHRNB2CHRNB4 | |
| SCHEMBL15918973 | 0.85 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1CHRM2L3MBTL3 | |
| SCHEMBL15918974 | 0.85 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1CHRM2L3MBTL3 |
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-2023073115-A1 | PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2023-05-04 | — | — | WO | disclosed |