Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ASAH1 | Q13510 | 6/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29195624 | 1.00 | ASAH1 (0.53) | ASAH1HTTLMNASMN1; SMN2KMT2A | |
| SCHEMBL4437431 | 0.88 | ASAH1 (0.62) | ASAH1HTTLMNASMN1; SMN2KMT2A | |
| SCHEMBL11690100 | 0.86 | KMT2A (0.63) | ASAH1HTTLMNASMN1; SMN2KMT2A | |
| SCHEMBL30846012 | 0.82 | KMT2A (0.66) | ASAH1HTTSMN1; SMN2KMT2ACYP3A4 | |
| SCHEMBL29195653 | 0.82 | KMT2A (0.66) | ASAH1HTTSMN1; SMN2KMT2ACYP3A4 | |
| SCHEMBL11688725 | 0.80 | ASAH1 (0.50) | ASAH1KMT2AMEN1MAPTNPC1 | |
| SCHEMBL28073614 | 0.79 | ASAH1 (0.61) | ASAH1HTTLMNASMN1; SMN2KMT2A | |
| SCHEMBL29195585 | 0.77 | KMT2A (0.55) | ASAH1HTTLMNAKMT2AMEN1 | |
| SCHEMBL30846017 | 0.77 | KMT2A (0.55) | ASAH1HTTLMNAKMT2AMEN1 | |
| SCHEMBL28794689 | 0.76 | ASAH1 (0.57) | ASAH1HTTLMNASMN1; SMN2KMT2A |
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-117917274-A | Preparation method of novel metal@PCN catalyst and method for preparing 1,2, 4-thiadiazole derivative by using catalyst | 济宁医学院 | 2024-04-23 | — | — | CN | disclosed |