Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | DYRK3 | O43781 | 2/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.36 |
| ▸ | CDK9 | P50750 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | CASP1 | P29466 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | CASP7 | P55210 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23408638 | 0.75 | HTT (0.39) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL29618178 | 0.72 | NTRK1 (0.59) | NTRK1 | |
| SCHEMBL24074245 | 0.71 | HTT (0.51) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL22083655 | 0.71 | HTT (0.55) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL15258013 | 0.71 | HTT (0.59) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL22084144 | 0.70 | HTT (0.44) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL23408646 | 0.70 | HTT (0.35) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL26582556 | 0.70 | HTT (0.50) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL23666402 | 0.70 | HTT (0.58) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 | |
| SCHEMBL21637223 | 0.68 | HTT (0.40) | HTTSMN1; SMN2TDP1HSD17B10ALDH1A1 |
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 |