Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.43 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.43 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23218990 | 1.00 | PKM (0.46) | PKMNLRP3CYP4F2CYP4A11CA12 | |
| SCHEMBL2420372 | 0.85 | PKM (0.47) | PKMNLRP3CYP4F2CYP4A11CA12 | |
| SCHEMBL29511550 | 0.85 | PKM (0.53) | PKMNLRP3CYP4F2CYP4A11TBXAS1 | |
| SCHEMBL852520 | 0.85 | PKM (0.53) | PKMNLRP3CYP4F2CYP4A11TBXAS1 | |
| SCHEMBL29853174 | 0.83 | PKM (0.51) | PKMNLRP3CYP4F2CYP4A11CA12 | |
| SCHEMBL21438124 | 0.83 | PKM (0.51) | PKMNLRP3CYP4F2CYP4A11CA12 | |
| SCHEMBL15056307 | 0.83 | KDM4E (0.44) | CYP4F2CYP4A11CA2GABRA1GABRB2 | |
| SCHEMBL23229160 | 0.83 | ALOX5 (0.53) | PKMTBXAS1KMT2AALDH1A1GAA | |
| SCHEMBL671835 | 0.83 | PKM (0.44) | PKMNLRP3CYP4F2CYP4A11TBXAS1 | |
| SCHEMBL31053240 | 0.83 | PKM (0.44) | PKMNLRP3CYP4F2CYP4A11TBXAS1 |
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-118176187-A | Condensed ring compound, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2024-06-11 | — | — | CN | disclosed |