Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30108029 | 0.87 | ALDH1A1 (0.45) | ALDH1A1MAPTHPGDLMNAKDM4E | |
| SCHEMBL30108023 | 0.82 | PTGS1 (0.47) | ALDH1A1MAPTHPGDLMNAKDM4E | |
| SCHEMBL30107994 | 0.77 | PTGS1 (0.50) | ALDH1A1MAPTHPGDKDM4ETSHR | |
| SCHEMBL30108014 | 0.76 | KDM4E (0.42) | ALDH1A1HPGDKDM4ETSHRGAA | |
| SCHEMBL30107980 | 0.75 | ROCK1 (0.45) | ALDH1A1HPGDKDM4ETSHRNPC1 | |
| SCHEMBL30107982 | 0.75 | GAA (0.45) | ALDH1A1MAPTHPGDLMNAKDM4E | |
| SCHEMBL30107959 | 0.74 | KDM4E (0.44) | ALDH1A1HPGDKDM4ETSHRGAA | |
| SCHEMBL30108012 | 0.74 | TSHR (0.58) | ALDH1A1HPGDKDM4EMAPK1TSHR | |
| SCHEMBL30108028 | 0.72 | KDM4E (0.43) | ALDH1A1HPGDKDM4ETSHRNPC1 | |
| SCHEMBL30107951 | 0.70 | PTGS1 (0.46) | ALDH1A1MAPTHPGDKDM4ETSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022203399-A1 | ADENOSINE A2A RECEPTOR ANTAGONIST AND USE THEREOF | 주식회사 스탠다임 | 2022-09-29 | — | — | WO | disclosed |