Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MPI | P34949 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21915888 | 0.89 | HSD17B1 (0.39) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL21915859 | 0.88 | HSD17B1 (0.39) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL17640486 | 0.88 | HSD17B1 (0.52) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL21915458 | 0.86 | HSD17B1 (0.37) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915476 | 0.86 | HSD17B1 (0.34) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL21915399 | 0.85 | HSD17B1 (0.48) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL21915271 | 0.84 | HSD17B1 (0.45) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL21915249 | 0.84 | HSD17B1 (0.37) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL21915289 | 0.84 | HSD17B1 (0.46) | HSD17B1HSD17B2MAPTSNCAKDM4E | |
| SCHEMBL21915272 | 0.83 | HSD17B1 (0.40) | HSD17B1HSD17B2MAPTSNCAKDM4E |
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 |