Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KCNQ2 | O43526 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.38 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL24227168 | 0.86 | ADRA2C (0.47) | KMT2AMAPK1LMNAHTR2AEGFR | |
| SCHEMBL4956719 | 0.84 | KCNQ2 (0.44) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| SCHEMBL3729747 | 0.84 | KCNQ2 (0.44) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| SCHEMBL7889064 | 0.84 | KCNQ2 (0.47) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| SCHEMBL2339105 | 0.83 | KEAP1 (0.46) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| SCHEMBL5792889 | 0.83 | KEAP1 (0.46) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| SCHEMBL22276693 | 0.83 | KCNQ2 (0.43) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| SCHEMBL7897470 | 0.83 | KEAP1 (0.46) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| Hydrochloric Acid SCHEMBL10638555 | 0.81 | KEAP1 (0.45) | MEN1KMT2AKCNQ2GAAKEAP1 | |
| SCHEMBL7896588 | 0.81 | KCNQ2 (0.44) | MEN1KMT2AKCNQ2GAAKEAP1 |
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-110156763-A | A kind of posaconazole derivative, pharmaceutical composition with and application thereof | 北京普祺医药科技有限公司 | 2019-08-23 | — | — | CN | disclosed |