Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.34 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.34 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.32 |
| ▸ | PGK2 | P07205 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.31 |
| ▸ | SHBG | P04278 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18804780 | 0.88 | RAPGEF4 (0.36) | PTGS1PTGS2CYP4F2CYP4A11AGBL2 | |
| SCHEMBL27129823 | 0.84 | GAA (0.32) | PTGS1PTGS2CYP4F2CYP4A11AGBL2 | |
| SCHEMBL22380034 | 0.81 | GABRA1 (0.44) | GCGRGABRA1GABRG2GABRB3 | |
| SCHEMBL21031362 | 0.81 | LMNA (0.33) | CYP4F2CYP4A11 | |
| SCHEMBL19126702 | 0.80 | GAA (0.38) | PTGS1PTGS2AGBL2CA12CA1 | |
| SCHEMBL95192 | 0.78 | HRH3 (0.40) | CA1PGK1PGK2RAPGEF4KDM4E | |
| SCHEMBL892872 | 0.78 | CA1 (0.48) | CA1PGK1PGK2SHBGKDM4E | |
| SCHEMBL13199148 | 0.76 | ACHE (0.43) | CYP4F2CYP4A11PGK1PGK2SHBG | |
| SCHEMBL3469757 | 0.76 | CYP3A4 (0.48) | SHBGKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL16693754 | 0.76 | RAPGEF4 (0.32) | PTGS1PTGS2AGBL2RAPGEF4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118851958-A | Acyl sulfonamide compound, preparation method and application thereof | 中国医学科学院药物研究所 | 2024-10-29 | — | — | CN | disclosed |
| CN-115710248-B | Novel selective estrogen receptor down-regulator compound, preparation method and application | 南京中医药大学 | 2024-06-21 | — | — | CN | disclosed |
| CN-116574054-A | Selective estrogen receptor down regulator compound, preparation method and application | 南京中医药大学 | 2023-08-11 | — | — | CN | disclosed |
| CN-115710248-A | Novel selective estrogen receptor down-regulator compounds, methods of preparation and uses | 南京中医药大学 | 2023-02-24 | — | — | CN | disclosed |
| EP-2562175-A1 | 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES | Dow AgroSciences LLC (US) | 2013-02-27 | — | — | EP | disclosed |