Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | NQO2 | P16083 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15624395 | 0.71 | KMT2A (0.51) | KDM1AAPPNQO2LMNAKDM4E | |
| SCHEMBL11718523 | 0.68 | ALDH1A1 (0.52) | TYMSKEAP1APPLMNAKDM4E | |
| SCHEMBL9587545 | 0.66 | KEAP1 (0.44) | KEAP1NQO2LMNAKDM4EPOLB | |
| SCHEMBL9587515 | 0.66 | EGFR (0.44) | APPNQO2KCNH2EGFR | |
| SCHEMBL5988872 | 0.65 | NQO2 (0.66) | NQO2LMNAKDM4EPOLBCASP6 | |
| SCHEMBL6848345 | 0.65 | LMNA (0.53) | KEAP1NQO2LMNAKDM4EPOLB | |
| SCHEMBL23485985 | 0.65 | RAD52 (0.49) | NQO2LMNAKDM4EPOLBDYRK3 | |
| SCHEMBL30496186 | 0.62 | ESR1 (0.58) | KDM1ALMNAKDM4EDHODHKDR | |
| SCHEMBL6605394 | 0.62 | NUDT1 (0.44) | NQO2LMNAKDM4EPOLBCASP6 | |
| SCHEMBL29042718 | 0.62 | ESR1 (0.58) | KDM1ALMNAKDM4EDHODHKDR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021110280-A1 | AMINOACRIDINE AND AMINOPYRENE DYES AND THEIR USE AS FLUORESCENT TAGS, IN PARTICULAR FOR CARBOHYDRATE ANALYSIS | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e. V. (DE) | 2021-06-10 | — | — | WO | disclosed |