Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | IDH2 | P48735 | 1/20 | 0.34 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8070478 | 0.86 | TSHR (0.43) | ALDH1A1KDM4EHTR7MAOAPTGS1 | |
| SCHEMBL7613516 | 0.80 | ALDH1A1 (0.38) | ALDH1A1KCNH3 | |
| SCHEMBL11255273 | 0.72 | APP (0.46) | ALDH1A1KDM4ETLR7 | |
| SCHEMBL7676182 | 0.72 | HTR2C (0.35) | ALDH1A1KDM4EIDH1IDH2TDP1 | |
| SCHEMBL7960038 | 0.71 | SCN9A (0.41) | ALDH1A1TLR7 | |
| SCHEMBL6982625 | 0.70 | TSHR (0.41) | KDM4EGAAHTR7 | |
| SCHEMBL7946808 | 0.70 | HTR7 (0.45) | ALDH1A1KCNH3HTR7MAOAPTGS1 | |
| SCHEMBL8084532 | 0.66 | ALDH1A1 (0.39) | ALDH1A1TLR7TDP1 | |
| SCHEMBL11445845 | 0.65 | MAOA (0.62) | MAOAPTGS1 | |
| SCHEMBL7615960 | 0.64 | CDK1 (0.32) | ALDH1A1IDH1IDH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1034168-A1 | SUBSTITUTED ARYLOXY ALKYL AMINO TRIAZINES | Bayer Aktiengesellschaft (DE) | 2000-09-13 | — | — | EP | disclosed |
| WO-1999021841-A1 | SUBSTITUTED ARYLOXY ALKYL AMINO TRIAZINES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-05-06 | — | — | WO | disclosed |