Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | ME2 | P23368 | 1/20 | 0.38 |
| ▸ | ME1 | P48163 | 1/20 | 0.38 |
| ▸ | ME3 | Q16798 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27762421 | 1.00 | NPC1 (0.50) | NPC1RAB9AMAPK1GAAMAPT | |
| SCHEMBL6784264 | 0.92 | NQO2 (0.49) | NPC1RAB9AMAPTGFERNQO2 | |
| SCHEMBL6784267 | 0.92 | NQO2 (0.49) | NPC1RAB9AMAPTGFERNQO2 | |
| SCHEMBL27729027 | 0.85 | L3MBTL1 (0.49) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL27708790 | 0.85 | PDPK1 (0.44) | NPC1RAB9AMAPK1MAPTCYP1A2 | |
| SCHEMBL28264296 | 0.84 | ABAT (0.52) | CYP2C19GFERNQO2ALDH1A1KDM4E | |
| SCHEMBL28263236 | 0.83 | LMNA (0.45) | RAB9AMAPTCYP1A2CYP2C19NQO2 | |
| SCHEMBL27565138 | 0.83 | FNTA (0.42) | RAB9AMAPK1MAPTNQO2ALDH1A1 | |
| SCHEMBL28271291 | 0.83 | ESR1 (0.44) | NPC1RAB9AMAPTCYP1A2CYP2D6 | |
| SCHEMBL27506745 | 0.83 | CYP3A4 (0.42) | NPC1RAB9AMAPK1SMN1; SMN2ALDH1A1 |
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-102010421-A | Artemisinin derivatives and application thereof | UNIV SHENYANG PHARMACEUTICAL | 2011-04-13 | — | — | CN | disclosed |