Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28590211 | 0.76 | ALDH1A1 (0.41) | GAATDP1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL2475315 | 0.76 | GAA (0.66) | GAATDP1ALDH1A1POLBTSHR | |
| SCHEMBL28595457 | 0.74 | HTR2A (0.42) | ALDH1A1 | |
| SCHEMBL11223006 | 0.72 | TDP1 (0.53) | GAATDP1ALDH1A1POLBTSHR | |
| SCHEMBL28294148 | 0.72 | TDP1 (0.53) | GAATDP1ALDH1A1POLBTSHR | |
| SCHEMBL28256635 | 0.72 | TDP1 (0.53) | GAATDP1ALDH1A1POLBTSHR | |
| SCHEMBL28296005 | 0.72 | TDP1 (0.53) | GAATDP1ALDH1A1POLBTSHR | |
| SCHEMBL6626162 | 0.72 | GAA (0.49) | GAATDP1ALDH1A1POLBTSHR | |
| SCHEMBL12896239 | 0.72 | GAA (0.49) | GAATDP1ALDH1A1POLBTSHR | |
| SCHEMBL3690450 | 0.72 | GAA (0.49) | GAATDP1ALDH1A1POLBTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-112778280-B | Anthraquinone natural product modified derivative | 中国医学科学院药用植物研究所 | 2022-05-10 | — | — | CN | disclosed |
| CN-112778280-A | Anthraquinone natural product modified derivative | 中国医学科学院药用植物研究所 | 2021-05-11 | — | — | CN | disclosed |