Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 2/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28633472 | 0.80 | CETP (0.35) | KDM4ETSHRMEN1KMT2ACETP | |
| SCHEMBL28641325 | 0.80 | L3MBTL1 (0.43) | KDM4ECYP2D6KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL29623492 | 0.78 | CASP1 (0.43) | CASP1PTGS1KDM4ETSHRMEN1 | |
| SCHEMBL28640739 | 0.77 | MAPT (0.44) | LMNAALDH1A1SMN1; SMN2L3MBTL1GAA | |
| SCHEMBL25722842 | 0.74 | HDAC4 (0.57) | CASP1PTGS1KDM4ETSHRMEN1 | |
| SCHEMBL28925133 | 0.74 | ALDH1A1 (0.42) | CASP1KMT2ALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL28631825 | 0.74 | LMNA (0.41) | TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL28651923 | 0.72 | RIPK1 (0.35) | CASP1KDM4EMEN1KMT2APPARG | |
| SCHEMBL13160048 | 0.71 | AR (0.48) | CASP1PTGS1KDM4ETSHRMEN1 | |
| SCHEMBL13255810 | 0.71 | CASP1 (0.46) | CASP1PTGS1KDM4ETSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113493419-A | EGFR tyrosine kinase inhibitor and application thereof | 南京药石科技股份有限公司 | 2021-10-12 | — | — | CN | disclosed |