Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7784207 | 0.82 | — | — | |
| SCHEMBL9620593 | 0.78 | KEAP1 (0.33) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL7885338 | 0.78 | KEAP1 (0.33) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL1199933 | 0.78 | — | — | |
| SCHEMBL4543577 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TP53CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL4562684 | 0.72 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL2879342 | 0.71 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL7885340 | 0.71 | HCAR2 (0.43) | ALDH1A1TP53 | |
| SCHEMBL9620594 | 0.71 | HCAR2 (0.43) | ALDH1A1TP53 | |
| SCHEMBL2456544 | 0.71 | ELANE (0.36) | ALDH1A1MAPK1HIF1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2001316332-A | METHOD FOR PRODUCING DIALKYL CARBONATE | NIPPON SHOKUBAI CO LTD | 2001-11-13 | — | — | JP | disclosed |
| US-5159003-A | Alipratic disulfide ester, aroamtic hydroxy, carboxy or acyl halide agents | FERRO CORPORATION (US) | 1992-10-27 | — | — | US | disclosed |