Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9789563 | 0.82 | KMT2A (0.53) | CYP1A2CYP2C19KMT2ALMNATSHR | |
| SCHEMBL9789561 | 0.82 | KMT2A (0.53) | CYP1A2CYP2C19KMT2ALMNATSHR | |
| SCHEMBL9789558 | 0.82 | KMT2A (0.53) | CYP1A2CYP2C19KMT2ALMNATSHR | |
| SCHEMBL16306898 | 0.78 | KMT2A (0.57) | KMT2ALMNACA1CA2CA9 | |
| SCHEMBL30490492 | 0.78 | — | — | |
| SCHEMBL13990902 | 0.77 | KCNH3 (0.33) | KMT2A | |
| SCHEMBL8367694 | 0.74 | CYP1A2 (0.49) | CYP1A2CYP2C19KMT2ALMNATSHR | |
| SCHEMBL28999683 | 0.74 | CYP1A2 (0.49) | CYP1A2CYP2C19KMT2ALMNATSHR | |
| SCHEMBL13990780 | 0.72 | SLC29A1 (0.42) | CYP1A2CYP2C19KMT2ALMNATSHR | |
| SCHEMBL9528867 | 0.72 | LMNA (0.67) | CYP1A2CYP2C19KMT2ALMNAGAA |
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-114560819-B | Substituted triazine compound, preparation method thereof and application thereof in amino acid, peptide, protein and cell marker | 中国海洋大学 | 2023-09-19 | — | — | CN | disclosed |
| CN-114560819-A | Substituted triazine compound, preparation method thereof and application thereof in amino acid, peptide, protein and cell marker | 中国海洋大学 | 2022-05-31 | — | — | CN | disclosed |