Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | GSK3B | P49841 | 3/20 | 0.54 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | CASP2 | P42575 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.47 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.47 |
| ▸ | TLK2 | Q86UE8 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.38 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Naphthoquinone SCHEMBL29259751 | 0.82 | ALDH1A1 (0.57) | SMN1; SMN2ALDH1A1TLK2CYP1A2TP53 | |
| Benzene SCHEMBL1648398 | 0.76 | ALDH1A1 (0.89) | SMN1; SMN2ALDH1A1NPC1RAB9ATAAR1 | |
| Benzene SCHEMBL28115465 | 0.76 | ALDH1A1 (0.89) | SMN1; SMN2ALDH1A1NPC1RAB9ATAAR1 | |
| SCHEMBL167 | 0.76 | — | — | |
| SCHEMBL9244226 | 0.76 | ALDH1A1 (1.00) | SMN1; SMN2ALDH1A1NPC1RAB9ATAAR1 | |
| SCHEMBL9145211 | 0.76 | ALDH1A1 (1.00) | SMN1; SMN2ALDH1A1NPC1RAB9ATAAR1 | |
| Phthalimide SCHEMBL23063638 | 0.73 | GSK3B (0.88) | SMN1; SMN2ALDH1A1GSK3BCASP3CASP2 | |
| Phthalimide SCHEMBL6890310 | 0.73 | GSK3B (0.88) | SMN1; SMN2ALDH1A1GSK3BCASP3CASP2 | |
| Bromide SCHEMBL5133664 | 0.73 | — | — | |
| Iodide SCHEMBL3910065 | 0.73 | — | — |
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-1046286-C | Novel cephem derivatives | MEIJI SEIKA CO (JP) | 1999-11-10 | — | — | CN | disclosed |