Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.31 |
| ▸ | SNCA | P37840 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21915290 | 0.88 | HSD17B1 (0.45) | HSD17B1HSD17B2MAPTKDM4EALDH1A1 | |
| SCHEMBL21915205 | 0.86 | HSD17B1 (0.40) | HSD17B1HSD17B2MAPTKDM4EALDH1A1 | |
| SCHEMBL21915469 | 0.85 | HSD17B1 (0.43) | HSD17B1HSD17B2MAPTKDM4EALDH1A1 | |
| SCHEMBL21915214 | 0.83 | HSD17B1 (0.36) | HSD17B1HSD17B2MAPTCYP19A1SNCA | |
| SCHEMBL21915515 | 0.83 | HSD17B1 (0.39) | HSD17B1HSD17B2MAPTKDM4EALDH1A1 | |
| SCHEMBL21915212 | 0.83 | HSD17B1 (0.33) | HSD17B1HSD17B2KDM4ETP53 | |
| SCHEMBL21915611 | 0.82 | HSD17B1 (0.40) | HSD17B1HSD17B2MAPTCYP19A1SNCA | |
| SCHEMBL17640615 | 0.81 | CYP19A1 (0.41) | HSD17B1HSD17B2MAPTKDM4EALDH1A1 | |
| SCHEMBL17640563 | 0.81 | CYP19A1 (0.41) | HSD17B1HSD17B2MAPTKDM4EALDH1A1 | |
| SCHEMBL21915468 | 0.81 | CYP19A1 (0.40) | HSD17B1HSD17B2MAPTALDH1A1MAPK1 |
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 |