Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.70 |
| ▸ | IKBKB | O14920 | 5/20 | 0.53 |
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | FADS1 | O60427 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.45 |
| ▸ | CHUK | O15111 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL183930 | 1.00 | KEAP1 (0.70) | KEAP1IKBKBCES2CES1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4362930 | 0.98 | KEAP1 (0.68) | KEAP1IKBKBCES2CES1ALDH1A1 | |
| Anthranilamide SCHEMBL4012579 | 0.91 | KEAP1 (0.59) | KEAP1IKBKBCES2CES1ALDH1A1 | |
| SCHEMBL5308529 | 0.84 | IKBKB (0.71) | KEAP1IKBKBCHUKCYP1A2CYP3A4 | |
| SCHEMBL135091 | 0.83 | KEAP1 (1.00) | KEAP1CES2CES1ALDH1A1FADS1 | |
| SCHEMBL29364785 | 0.83 | KEAP1 (1.00) | KEAP1CES2CES1ALDH1A1FADS1 | |
| SCHEMBL148542 | 0.83 | KEAP1 (0.53) | KEAP1IKBKBCES2CES1ALDH1A1 | |
| SCHEMBL29463969 | 0.82 | CES2 (0.52) | KEAP1IKBKBCES2CES1ALDH1A1 | |
| SCHEMBL12070396 | 0.82 | KEAP1 (0.63) | KEAP1IKBKBCES2CES1ALDH1A1 | |
| SCHEMBL9000281 | 0.81 | KEAP1 (0.96) | KEAP1CES2CES1ALDH1A1FADS1 |
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-119019339-A | Preparation method of quinazolinone compound promoted by mercaptan without catalyst | 南京化纤股份有限公司 | 2024-11-26 | — | — | CN | disclosed |