Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 3/20 | 0.37 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 3/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.36 |
| ▸ | FRK | P42685 | 2/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL24312484 | 0.82 | DPP4 (0.46) | CASP6MAPK14MAPK10EGFRCYP46A1 | |
| SCHEMBL7503631 | 0.82 | CASP6 (0.42) | CASP6MAPK14EGFRCYP46A1MAPK9 | |
| SCHEMBL24312483 | 0.82 | CYP2D6 (0.43) | CASP6EGFRCYP46A1CYP2D6CYP1A2 | |
| Hydrochloric Acid SCHEMBL29473296 | 0.81 | DPP4 (0.44) | CASP6MAPK14MAPK10EGFRCYP46A1 | |
| SCHEMBL10601314 | 0.80 | MAPK9 (0.43) | CASP6MAPK14MAPK10EGFRCYP46A1 | |
| SCHEMBL4600282 | 0.79 | KDM4E (0.50) | CYP1A2ALDH1A1HSD17B10KDM4EMAPT | |
| SCHEMBL28172764 | 0.79 | CYP46A1 (0.43) | CASP6MAPK14CYP46A1MAPK9CYP2D6 | |
| Hydrochloric Acid SCHEMBL29723641 | 0.78 | TAAR1 (0.39) | CASP6EGFR | |
| Hydrochloric Acid SCHEMBL23498194 | 0.78 | TAAR1 (0.39) | CASP6EGFR | |
| SCHEMBL28144745 | 0.78 | ALOX5AP (0.40) | CASP6MAPK14EGFRCYP46A1MAPK9 |
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-106794161-A | TrkA kinase inhibitors, composition and its method | 默沙东公司 | 2017-05-31 | — | — | CN | disclosed |