Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | STAT3 | P40763 | 6/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SNCA | P37840 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL29426013 | 0.91 | SNCA (0.51) | HSP90AA1CA9CA2CYP3A4KDM4E | |
| SCHEMBL29425950 | 0.90 | PRKCA (0.50) | HSP90AA1CA9CA2CYP3A4STAT3 | |
| SCHEMBL31467364 | 0.77 | STAT3 (0.66) | ELANESTAT3MAPT | |
| SCHEMBL29546041 | 0.72 | HSP90AA1 (0.76) | HSP90AA1CA9ELANECA2CYP3A4 | |
| Grandidentatin SCHEMBL29891462 | 0.69 | HSP90AA1 (0.50) | HSP90AA1CA9CA2CYP3A4KDM4E | |
| SCHEMBL27821591 | 0.67 | F3 (0.49) | CA9CA2CYP3A4KDM4EMAPT | |
| SCHEMBL10075935 | 0.67 | CA9 (0.53) | HSP90AA1CA9ELANECA2CA12 | |
| SCHEMBL29536291 | 0.67 | PTPN1 (0.61) | HSP90AA1CA9CA2CYP3A4CA12 | |
| SCHEMBL29536623 | 0.67 | PTPN1 (0.61) | HSP90AA1CA9CA2CYP3A4CA12 | |
| Arbortristoside C SCHEMBL422794 | 0.67 | ELANE (0.62) | HSP90AA1ELANESTAT3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3409766-B1 | AN ESTERASE THAT IS CAPABLE OF CONVERTING IRIDOIDS AND SECO-IRIDOIDS | N ZYME BIOTEC GMBH (DE) | 2022-03-09 | — | — | EP | disclosed |