Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.61 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.61 |
| ▸ | TNKS | O95271 | 5/20 | 0.56 |
| ▸ | TNKS2 | Q9H2K2 | 5/20 | 0.56 |
| ▸ | PARP1 | P09874 | 4/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | HPGDS | O60760 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28677334 | 0.91 | MAPT (0.53) | NR1H2NR1H3TNKSTNKS2PARP1 | |
| SCHEMBL28675222 | 0.85 | PARP1 (0.55) | TNKSTNKS2PARP1GAAMEN1 | |
| SCHEMBL28682476 | 0.85 | NR1H2 (0.59) | NR1H2NR1H3TNKSTNKS2GAA | |
| SCHEMBL28675746 | 0.85 | NR1H2 (0.59) | NR1H2NR1H3TNKSTNKS2PARP1 | |
| SCHEMBL28672620 | 0.85 | TNKS (0.55) | NR1H2NR1H3TNKSTNKS2PARP1 | |
| SCHEMBL28685099 | 0.83 | GSK3B (0.56) | GAAALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL28671719 | 0.83 | NPC1 (0.59) | TNKSTNKS2PARP1GAAALDH1A1 | |
| SCHEMBL28676032 | 0.81 | TNKS (0.58) | TNKSTNKS2PARP1HPGDRAB9A | |
| SCHEMBL28671250 | 0.80 | TNKS (0.59) | TNKSTNKS2PARP1MEN1KMT2A | |
| SCHEMBL23108627 | 0.78 | L3MBTL1 (0.70) | NR1H2NR1H3ALDH1A1KDM4EMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113173889-B | Method for synthesizing 1,3, 5-triazine derivative | 新乡市润宇新材料科技有限公司 | 2023-11-10 | — | — | CN | disclosed |
| CN-113173889-A | Method for synthesizing 1,3, 5-triazine derivative | 新乡市润宇新材料科技有限公司 | 2021-07-27 | — | — | CN | disclosed |