Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 1.00 |
| ▸ | HIF1A | Q16665 | 2/20 | 1.00 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.61 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.60 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.57 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.57 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.57 |
| ▸ | HSPB1 | P04792 | 3/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL35276 | 1.00 | ALDH1A1 (1.00) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| SCHEMBL29349904 | 1.00 | ALDH1A1 (1.00) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| SCHEMBL28309178 | 0.98 | ALDH1A1 (0.96) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| Benzene SCHEMBL28794915 | 0.96 | ALDH1A1 (0.92) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| Methyl Alcohol SCHEMBL27725897 | 0.94 | ALDH1A1 (0.89) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| Methylene Chloride SCHEMBL28308391 | 0.92 | ALDH1A1 (0.85) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| Acetone SCHEMBL27892886 | 0.91 | ALDH1A1 (0.82) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| Alcohol SCHEMBL27914560 | 0.89 | ALDH1A1 (0.79) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| Acetonitrile SCHEMBL27709629 | 0.89 | ALDH1A1 (0.79) | ALDH1A1HIF1ATDP1VCAM1GPR35 | |
| SCHEMBL28285059 | 0.89 | ALDH1A1 (0.79) | ALDH1A1HIF1ATDP1VCAM1GPR35 |
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-101103036-B | Artemisinin derivative, preparation method and application thereof, and pharmaceutical composition comprising artemisinin derivative | SHANGHAI INST MATERIA MEDICA | 2010-05-19 | — | — | CN | disclosed |
| CN-101103036-A | Artemisinin derivative, preparation method and application thereof, and pharmaceutical composition comprising artemisinin derivative | SHANGHAI INST MATERIA MEDICA (CN) | 2008-01-09 | — | — | CN | disclosed |