Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 5/20 | 0.53 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.49 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.49 |
| ▸ | CTRC | Q99895 | 2/20 | 0.46 |
| ▸ | GLB1 | P16278 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 5/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28760749 | 1.00 | CTSD (0.53) | CTSDHSPD1HSPE1CTRCGLB1 | |
| SCHEMBL28942660 | 0.85 | CTSD (0.51) | CTSDHSPD1HSPE1MEN1MAPT | |
| SCHEMBL29612906 | 0.85 | CTSD (0.51) | CTSDHSPD1HSPE1MEN1MAPT | |
| SCHEMBL29612924 | 0.80 | CTSD (0.64) | CTSDHSPD1HSPE1ALOX5MEN1 | |
| SCHEMBL28760809 | 0.80 | CTSD (0.64) | CTSDHSPD1HSPE1ALOX5MEN1 | |
| SCHEMBL29612959 | 0.80 | CTSD (0.66) | CTSDHSPD1HSPE1ALOX5MEN1 | |
| SCHEMBL28760788 | 0.80 | CTSD (0.66) | CTSDHSPD1HSPE1ALOX5MEN1 | |
| SCHEMBL28760743 | 0.76 | HSPD1 (0.69) | CTSDHSPD1HSPE1ALOX5MEN1 | |
| SCHEMBL29612961 | 0.76 | HSPD1 (0.69) | CTSDHSPD1HSPE1ALOX5MEN1 | |
| SCHEMBL28760759 | 0.76 | CTSD (0.61) | CTSDHSPD1HSPE1ALOX5MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114524780-A | Mercaptobenzothiazole urea compound, pharmaceutical preparation, preparation method and application | 绍兴市上虞区武汉理工大学高等研究院 | 2022-05-24 | — | — | CN | disclosed |