Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.57 |
| ▸ | MPO | P05164 | 3/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14116547 | 0.92 | MPO (0.56) | PTGS1PTGS2MPOESR2CYP1A2 | |
| SCHEMBL29100454 | 0.84 | MPO (0.53) | PTGS1PTGS2MPOCYP1A2CYP2C9 | |
| SCHEMBL28596268 | 0.84 | GAA (0.54) | PTGS1PTGS2MPOESR2MAPT | |
| SCHEMBL29100463 | 0.84 | PTGS1 (0.47) | PTGS1PTGS2MPOESR2CYP1A2 | |
| SCHEMBL29100453 | 0.84 | PTGS1 (0.47) | PTGS1PTGS2MPOESR2CYP1A2 | |
| SCHEMBL29100461 | 0.84 | MAPT (0.52) | PTGS1PTGS2MPOESR2MAPT | |
| SCHEMBL31268509 | 0.82 | PTGS1 (0.48) | PTGS1PTGS2MPOESR2CYP1A2 | |
| SCHEMBL29100462 | 0.80 | CA1 (0.58) | PTGS1PTGS2MPOCA1CA2 | |
| SCHEMBL30539481 | 0.80 | CA1 (0.58) | PTGS1PTGS2MPOCA1CA2 | |
| SCHEMBL29100460 | 0.80 | PTGS1 (0.50) | PTGS1PTGS2MPOMAPTMEN1 |
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-116815207-A | Electrochemical synthesis method of 2H-indazole compound | 淮北师范大学 | 2023-09-29 | — | — | CN | disclosed |