Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.67 |
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | GAA | P10253 | 2/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.67 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA4 | P22748 | 2/20 | 0.58 |
| ▸ | CA7 | P43166 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.58 |
| ▸ | CA3 | P07451 | 1/20 | 0.58 |
| ▸ | CA6 | P23280 | 1/20 | 0.58 |
| ▸ | CA5A | P35218 | 1/20 | 0.58 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30301309 | 1.00 | ALDH1A1 (0.67) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL10454908 | 0.81 | ALDH1A1 (0.76) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL19520569 | 0.80 | CA12 (0.77) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL30471934 | 0.79 | KDM4E (0.97) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL22084101 | 0.79 | CA12 (0.74) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL1493188 | 0.78 | ALDH1A1 (0.67) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL1493191 | 0.78 | CA12 (0.79) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL11111574 | 0.78 | ALDH1A1 (0.90) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL11283741 | 0.77 | CA12 (0.77) | ALDH1A1HSD17B10KDM4ETSHRGAA | |
| SCHEMBL11092853 | 0.77 | CA12 (0.83) | ALDH1A1HSD17B10KDM4ETSHRGAA |
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-115745887-A | Novel naphthylhydrazine, sugar naphthylhydrazone, synthesis method thereof and monosaccharide detection method | 安徽中医药大学 | 2023-03-07 | — | — | CN | disclosed |