Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17494172 | 0.83 | ALDH1A1 (0.48) | ALDH1A1HSD17B10PTGS2PTPRCADORA2A | |
| SCHEMBL18342129 | 0.74 | ALDH1A1 (0.65) | ALDH1A1HSD17B10PTGS2CA12CA1 | |
| SCHEMBL3780645 | 0.73 | ALDH1A1 (0.58) | ALDH1A1HSD17B10DPP4L3MBTL1 | |
| SCHEMBL3789187 | 0.73 | ALDH1A1 (0.58) | ALDH1A1HSD17B10DPP4L3MBTL1FOLH1 | |
| SCHEMBL18065892 | 0.73 | ALDH1A1 (0.48) | ALDH1A1HSD17B10PTPRCADORA2ACA12 | |
| SCHEMBL31570105 | 0.72 | ALDH1A1 (0.56) | ALDH1A1HSD17B10DPP4L3MBTL1MAPT | |
| SCHEMBL20263706 | 0.72 | ALDH1A1 (0.56) | ALDH1A1HSD17B10DPP4L3MBTL1MAPT | |
| SCHEMBL27932763 | 0.71 | ALDH1A1 (0.50) | ALDH1A1HSD17B10PTPRCADORA2ADPP4 | |
| SCHEMBL7366245 | 0.71 | ALDH1A1 (0.42) | ALDH1A1HSD17B10PTGS2PTPRCADORA2A | |
| SCHEMBL27801796 | 0.70 | ALDH1A1 (0.48) | ALDH1A1HSD17B10MAPTFOLH1BCAT2 |
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-110036001-B | Benzo [ b ] thiophene compounds as STING agonists | 默沙东公司 | 2022-03-22 | — | — | CN | disclosed |