Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.37 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | NT5E | P21589 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CASP6 | P55212 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | SNCA | P37840 | 2/20 | 0.32 |
| ▸ | ING2 | Q9H160 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2183851 | 0.98 | ALDH1A1 (0.38) | ALDH1A1HSD17B10CA1CA2CA12 | |
| SCHEMBL4020727 | 0.81 | CA2 (0.49) | ALDH1A1HSD17B10CA1CA2CA12 | |
| SCHEMBL20262165 | 0.73 | MAOB (0.61) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL20262174 | 0.71 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CA1CA2CA12 | |
| SCHEMBL4145462 | 0.71 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CA1CA2CA12 | |
| SCHEMBL19729091 | 0.70 | MEN1 (0.30) | ALDH1A1 | |
| SCHEMBL9508137 | 0.67 | ALDH1A1 (0.45) | ALDH1A1HSD17B10CA1CA2CA12 | |
| SCHEMBL29320450 | 0.67 | CA1 (0.41) | ALDH1A1HSD17B10CA1CA2CA12 | |
| SCHEMBL10889794 | 0.67 | SNCA (0.55) | ALDH1A1HSD17B10LMNATSHRTDP1 | |
| SCHEMBL5187476 | 0.67 | CA12 (0.57) | CA1CA2CA12CA7CA14 |
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-110227483-A | A kind of novel magnetic nanometer simulation oxidizing ferment and its preparation method and application | 新乡医学院 | 2019-09-13 | — | — | CN | disclosed |