Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.51 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SNCA | P37840 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21915501 | 0.93 | HSD17B1 (0.49) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915507 | 0.86 | HSD17B1 (0.46) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL21915221 | 0.82 | HSD17B1 (0.39) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL23546613 | 0.81 | ALDH1A1 (0.50) | MAPTALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL23546615 | 0.81 | L3MBTL1 (0.51) | HSD17B1HSD17B2MAPTALDH1A1TSHR | |
| SCHEMBL23546616 | 0.81 | ALDH1A1 (0.50) | MAPTALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL21915548 | 0.81 | PDE6D (0.40) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL23546617 | 0.79 | ALDH1A1 (0.52) | MAPTALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL17570204 | 0.79 | HSD17B1 (0.66) | HSD17B1HSD17B2MAPTSNCACYP19A1 | |
| SCHEMBL3945288 | 0.79 | ALDH1A1 (0.60) | HSD17B1HSD17B2MAPTALDH1A1TSHR |
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 |