Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 5/20 | 0.75 |
| ▸ | GAA | P10253 | 2/20 | 0.71 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | XIAP | P98170 | 1/20 | 0.67 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | EGFR | P00533 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | SDCBP | O00560 | 1/20 | 0.51 |
| ▸ | SDC2 | P34741 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL20527803 | 0.86 | THRB (0.70) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL18360830 | 0.86 | THRB (0.70) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL21473669 | 0.86 | THRB (0.79) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL22997167 | 0.86 | THRB (0.79) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL21473573 | 0.85 | THRB (1.00) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL20527801 | 0.84 | THRB (0.83) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL18360734 | 0.84 | THRB (0.83) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL20527890 | 0.84 | THRB (0.83) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL20527800 | 0.84 | THRB (0.83) | THRBGAAKDM4EALDH1A1ALOX15 | |
| SCHEMBL18360735 | 0.84 | THRB (0.83) | THRBGAAKDM4EALDH1A1ALOX15 |
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-3778586-A1 | QUINAZOLINE COMPOUND SERVING AS EGFR TRIPLE MUTATION INHIBITOR AND APPLICATIONS THEREOF | East China University of Science and Technology (CN) | 2021-02-17 | — | — | EP | disclosed |