Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.69 |
| ▸ | USP2 | O75604 | 3/20 | 0.69 |
| ▸ | PKM | P14618 | 1/20 | 0.69 |
| ▸ | HPGD | P15428 | 2/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.61 |
| ▸ | IDO1 | P14902 | 1/20 | 0.57 |
| ▸ | TDO2 | P48775 | 1/20 | 0.57 |
| ▸ | F2 | P00734 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | MMP9 | P14780 | 2/20 | 0.52 |
| ▸ | MMP8 | P22894 | 2/20 | 0.52 |
| ▸ | MMP2 | P08253 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13274391 | 0.88 | ALDH1A1 (0.71) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL29458128 | 0.88 | ALDH1A1 (0.71) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL3487734 | 0.88 | ALDH1A1 (0.71) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL28454292 | 0.87 | ALDH1A1 (0.70) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL29458096 | 0.87 | ALDH1A1 (0.70) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL29458120 | 0.86 | ALDH1A1 (0.69) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL28459576 | 0.86 | ALDH1A1 (0.69) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL29458109 | 0.86 | ALDH1A1 (0.69) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL29458074 | 0.85 | ALDH1A1 (0.67) | ALDH1A1USP2PKMHPGDHSD17B10 | |
| SCHEMBL15337338 | 0.84 | KDM4E (0.72) | ALDH1A1USP2PKMHPGDHSD17B10 |
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-111518086-B | Oxoindole-naphthofuran derivatives, preparation method and application thereof, and pharmaceutical composition and preparation containing same | 广州医科大学 | 2021-08-06 | — | — | CN | claimed |