Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.35 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.35 |
| ▸ | HTR3B | O95264 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.35 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25920707 | 0.92 | KDM4E (0.49) | KDM4EGAAMAPTIDO1HTR3E | |
| SCHEMBL24149163 | 0.74 | IRAK4 (0.41) | PIM1PIM2 | |
| SCHEMBL18731514 | 0.74 | IRAK4 (0.38) | PIM1PIM2 | |
| SCHEMBL9427937 | 0.72 | ADRA1D (0.47) | KDM4EGAAMAPTIDO1ROCK2 | |
| SCHEMBL29952569 | 0.72 | KDM4E (0.56) | KDM4EGAAMAPTIDO1HSD17B10 | |
| SCHEMBL17734081 | 0.70 | ALDH1A1 (0.39) | KDM4EGAAMAPTIDO1LMNA | |
| SCHEMBL10057752 | 0.70 | POLB (0.43) | KDM4EGAAMAPTIDO1HSD17B10 | |
| SCHEMBL12098689 | 0.70 | MEN1 (0.31) | LMNA | |
| SCHEMBL11521138 | 0.69 | KDM4E (0.69) | KDM4EGAAMAPTIDO1HSD17B10 | |
| SCHEMBL14185338 | 0.68 | MAPT (0.37) | KDM4EGAAMAPTIDO1HSD17B10 |
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 |