Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21915703 | 0.89 | DHFR (0.39) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL21915541 | 0.85 | PDE6D (0.36) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL21915597 | 0.82 | KDM4E (0.43) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL17227637 | 0.78 | MAPT (0.54) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| Biphenyl SCHEMBL27770404 | 0.77 | ALDH1A1 (0.50) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL23590347 | 0.76 | MAPT (0.53) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL21309285 | 0.76 | MAPT (0.53) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL22766642 | 0.75 | MAPT (0.51) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL16355276 | 0.75 | MAPT (0.51) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL22766462 | 0.75 | MAPT (0.51) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD |
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-2020062375-A1 | 1,2,4-THIADIAZOLE COMPOUNDS AND PREPARATION METHOD THEREFOR AND USE THEREOF | 武汉尚赛光电科技有限公司 | 2020-04-02 | — | — | WO | disclosed |