Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | FOS | P01100 | 2/20 | 0.32 |
| ▸ | JUN | P05412 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.32 |
| ▸ | RELA | Q04206 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11524601 | 0.85 | HTT (0.34) | ALDH1A1KDM4EHSD17B10LMNATLR8 | |
| SCHEMBL11790398 | 0.82 | AOC3 (0.37) | AOC3ALDH1A1KDM4EMAPK1HSD17B10 | |
| SCHEMBL11202958 | 0.81 | AOC3 (0.32) | AOC3 | |
| SCHEMBL2148346 | 0.80 | AOC3 (0.38) | AOC3ALDH1A1KDM4EMAPK1HSD17B10 | |
| SCHEMBL2876075 | 0.76 | ALOX15 (0.41) | ALDH1A1SMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL13727051 | 0.75 | LMNA (0.30) | TSHRLMNA | |
| SCHEMBL10689547 | 0.74 | AOC3 (0.34) | AOC3ALDH1A1KDM4EMAPK1HSD17B10 | |
| SCHEMBL7606690 | 0.74 | NOS3 (0.31) | FOSJUNNFKB1NFKB2RELA | |
| SCHEMBL10998377 | 0.72 | DHFR (0.33) | — | |
| SCHEMBL15196099 | 0.72 | TSHR (0.30) | TSHRSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3399968-B1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LTD (KY) | 2021-10-20 | — | — | EP | disclosed |