Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28526303 | 1.00 | HSD17B10 (0.44) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL24693398 | 0.96 | HSD11B1 (0.41) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL20558459 | 0.96 | HSD11B1 (0.41) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL31299297 | 0.93 | ALDH1A1 (0.40) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL30782216 | 0.89 | HSD11B1 (0.39) | HSD17B10ALDH1A1SMN1; SMN2NPC1HSD11B1 | |
| SCHEMBL22725293 | 0.82 | HSD17B10 (0.48) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL22725305 | 0.82 | HSD17B10 (0.48) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL28521198 | 0.82 | HSD17B10 (0.48) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL25970105 | 0.81 | HSD17B10 (0.50) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL25970081 | 0.81 | HSD17B10 (0.50) | HSD17B10ALDH1A1SMN1; SMN2NPC1MEN1 |
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-112442029-A | Tetrahydropyrido [3,4-d ] pyrimidine derivative and application thereof in medicine | 四川海思科制药有限公司 | 2021-03-05 | — | — | CN | disclosed |