Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | PIEZO1 | Q92508 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28446500 | 0.84 | TSHR (0.58) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28445490 | 0.81 | TSHR (0.57) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28453972 | 0.80 | MAPK1 (0.54) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28452388 | 0.79 | TSHR (0.49) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28449603 | 0.79 | MAPK1 (0.49) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28448687 | 0.78 | MGAM (0.54) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28448690 | 0.77 | PTK2 (0.56) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28453905 | 0.76 | ALDH1A1 (0.57) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28453935 | 0.75 | PTK2 (0.56) | MAPK1TSHRLMNAALDH1A1HSD17B10 | |
| SCHEMBL28452384 | 0.75 | PTK2 (0.56) | MAPK1TSHRLMNAALDH1A1HSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106916150-B | 1,3, 4-oxadiazole-2-methylthio-benzothiazole derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2020-08-25 | — | — | CN | claimed |
| CN-106916150-B | 1,3, 4-oxadiazole-2-methylthio-benzothiazole derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2020-08-25 | — | — | CN | disclosed |