Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.49 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.49 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18646159 | 1.00 | ALDH1A1 (0.57) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL19534108 | 0.96 | CYP2A6 (0.56) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL24889767 | 0.95 | ALDH1A1 (0.56) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL23606122 | 0.94 | CYP2A6 (0.54) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL30427162 | 0.91 | CYP11B1 (0.54) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL19637770 | 0.91 | CYP11B1 (0.54) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL13492087 | 0.91 | CYP2A6 (0.54) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL18731737 | 0.90 | MEN1 (0.61) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL18019471 | 0.90 | MEN1 (0.61) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL29517880 | 0.89 | SMN1; SMN2 (0.54) | ALDH1A1CYP1A2SMN1; SMN2MEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118908907-A | Compound and organic electroluminescent element using same | 索路思高新材料有限公司 | 2024-11-08 | — | — | CN | disclosed |
| CN-118908906-A | Compound and organic electroluminescent element using same | 索路思高新材料有限公司 | 2024-11-08 | — | — | CN | disclosed |
| CN-116947774-A | Preparation method of 1,3,5-triazine derivative | 湖北尚赛光电材料有限公司 | 2023-10-27 | — | — | CN | disclosed |
| CN-116655549-A | Preparation method of polysubstituted 1,3,5-triazine derivative | 湖北尚赛光电材料有限公司 | 2023-08-29 | — | — | CN | disclosed |