Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 4/20 | 0.49 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.49 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.49 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | F13A1 | P00488 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.48 |
| ▸ | CA6 | P23280 | 2/20 | 0.48 |
| ▸ | CA5A | P35218 | 2/20 | 0.48 |
| ▸ | THPO | P40225 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3628865 | 0.94 | RELA (0.46) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL4169387 | 0.94 | RELA (0.46) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL2123615 | 0.93 | RELA (0.45) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL16429465 | 0.91 | ALDH1A1 (0.50) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL22401552 | 0.89 | ALDH1A1 (0.48) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL16247033 | 0.89 | ALDH1A1 (0.48) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL17541814 | 0.89 | ALDH1A1 (0.48) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL6429352 | 0.87 | ALDH1A1 (0.50) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL11830992 | 0.87 | ALDH1A1 (0.50) | RELAGNAI3GNAO1GNAI1TSHR | |
| SCHEMBL31563619 | 0.86 | ALDH1A1 (0.54) | GNAI3GNAO1GNAI1TSHRALDH1A1 |
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-110505864-A | Polyphenol/PEG-based hydrogel system for dental paints | DENTSPLY SIRONA INC | 2019-11-26 | — | — | CN | claimed |