Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7654223 | 0.88 | RIPK1 (0.39) | RIPK1ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL5431494 | 0.83 | HCAR2 (0.42) | ALDH1A1TSHRHCAR2ADRA2BADRA2A | |
| SCHEMBL29137515 | 0.82 | TSHR (0.41) | RIPK1ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL464725 | 0.78 | HCAR2 (0.45) | ALDH1A1TSHRHCAR2ADRA2BADRA2A | |
| SCHEMBL14387379 | 0.74 | MAPK1 (0.59) | RIPK1ALDH1A1HCAR2MAPK1ADRA2B | |
| Isopropylbenzene SCHEMBL2522337 | 0.74 | RIPK1 (0.42) | RIPK1ALDH1A1TSHRHSD17B10TDP1 | |
| SCHEMBL9502842 | 0.74 | RIPK1 (0.42) | RIPK1HCAR2MAPK1ADRA2BCACNA1F | |
| SCHEMBL11966010 | 0.74 | RIPK1 (0.42) | RIPK1HCAR2MAPK1ADRA2BCACNA1F | |
| SCHEMBL22959697 | 0.74 | RIPK1 (0.42) | RIPK1HCAR2MAPK1ADRA2BCACNA1F | |
| Isopropylbenzene SCHEMBL8373967 | 0.72 | ALDH1A1 (0.44) | RIPK1ALDH1A1TSHRHSD17B10TDP1 |
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-117142915-A | Method for synthesizing organic peroxy compound by decarboxylation of carboxylic acid under catalysis of visible light | 中国人民大学 | 2023-12-01 | — | — | CN | claimed |
| CN-117142915-A | Method for synthesizing organic peroxy compound by decarboxylation of carboxylic acid under catalysis of visible light | 中国人民大学 | 2023-12-01 | — | — | CN | disclosed |