Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.32 |
| ▸ | NPC1 | O15118 | 4/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | CASP1 | P29466 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | CASP7 | P55210 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.32 |
| ▸ | EIF2AK4 | Q9P2K8 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23408660 | 0.81 | NTRK1 (0.58) | NTRK1 | |
| SCHEMBL23408646 | 0.77 | HTT (0.35) | KDM4EHSD17B10NPC1SMN1; SMN2CASP1 | |
| SCHEMBL23408653 | 0.74 | NTRK1 (0.36) | NTRK1PIM1 | |
| SCHEMBL23408661 | 0.72 | CXCR4 (0.39) | SMN1; SMN2HTT | |
| SCHEMBL23408831 | 0.71 | HTT (0.34) | KDM4EHSD17B10NPC1SMN1; SMN2CASP1 | |
| SCHEMBL23408738 | 0.70 | NTRK1 (0.35) | NTRK1PIM1 | |
| SCHEMBL23408679 | 0.70 | NTRK1 (0.35) | MAPTNTRK1PIM1 | |
| SCHEMBL23408832 | 0.69 | KMT2A (0.36) | HSD17B10SMN1; SMN2ALDH1A1 | |
| SCHEMBL23408637 | 0.65 | HTT (0.43) | KDM4EHSD17B10NPC1SMN1; SMN2CASP1 | |
| SCHEMBL23408638 | 0.62 | HTT (0.39) | KDM4EHSD17B10NPC1SMN1; SMN2CASP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021098745-A1 | PREPARATION AND APPLICATION OF A CLASS OF PROTEIN RECEPTOR KINASE INHIBITORS | 上海轶诺药业有限公司 | 2021-05-27 | — | — | WO | disclosed |