Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 5/20 | 0.66 |
| ▸ | ESR1 | P03372 | 3/20 | 0.64 |
| ▸ | CA12 | O43570 | 3/20 | 0.63 |
| ▸ | CA1 | P00915 | 3/20 | 0.63 |
| ▸ | CA2 | P00918 | 3/20 | 0.63 |
| ▸ | CA7 | P43166 | 3/20 | 0.63 |
| ▸ | CA9 | Q16790 | 3/20 | 0.63 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.63 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.60 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.60 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.60 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | XDH | P47989 | 1/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Ethylgallate SCHEMBL39599 | 0.96 | SERPINE1 (0.70) | SERPINE1ESR1CA12CA1CA2 | |
| Ethylgallate SCHEMBL28018664 | 0.94 | SERPINE1 (0.63) | SERPINE1ESR1CA12CA1CA2 | |
| Ethylgallate SCHEMBL27840060 | 0.94 | SERPINE1 (0.68) | SERPINE1ESR1CA12CA1CA2 | |
| Ethylgallate SCHEMBL29200753 | 0.92 | SERPINE1 (0.66) | SERPINE1ESR1CA12CA1CA2 | |
| Ethylgallate SCHEMBL3716520 | 0.89 | KDM4E (0.75) | SERPINE1ESR1CA12CA1CA2 | |
| Ethylgallate SCHEMBL26626292 | 0.89 | SERPINE1 (0.61) | SERPINE1ESR1CA12CA1CA2 | |
| Ethylgallate SCHEMBL7744669 | 0.87 | CA12 (0.62) | SERPINE1ESR1CA12CA1CA2 | |
| Propyl Gallate SCHEMBL9232748 | 0.87 | ESR1 (0.73) | SERPINE1ESR1CA12CA1CA2 | |
| SCHEMBL15044101 | 0.87 | CA12 (0.61) | SERPINE1ESR1CA12CA1CA2 | |
| SCHEMBL23952745 | 0.86 | POLB (0.65) | SERPINE1ESR1CA12CA1CA2 |
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-116332998-A | Platinum complex and preparation and application thereof | 华东理工大学 | 2023-06-27 | — | — | CN | disclosed |