Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 17/20 | 0.57 |
| ▸ | ATXN2 | Q99700 | 15/20 | 0.57 |
| ▸ | HTR2A | P28223 | 1/20 | 0.57 |
| ▸ | ABAT | P80404 | 1/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29455213 | 1.00 | ENPP2 (0.57) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL15584278 | 0.85 | ENPP2 (0.80) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL29455205 | 0.83 | ENPP2 (0.67) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL28549864 | 0.83 | ENPP2 (0.67) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL28549865 | 0.83 | ENPP2 (0.67) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL15552718 | 0.82 | ENPP2 (0.80) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL28563416 | 0.79 | ENPP2 (0.54) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL29455218 | 0.79 | ENPP2 (0.54) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL29455216 | 0.79 | ENPP2 (0.54) | ENPP2ATXN2HTR2AABATSIGMAR1 | |
| SCHEMBL29455195 | 0.79 | ENPP2 (0.54) | ENPP2ATXN2HTR2AABATSIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112778274-B | Nitrogen-containing heterocyclic derivative and preparation thereof | 四川海思科制药有限公司 | 2022-02-15 | — | — | CN | disclosed |
| CN-112778274-A | Nitrogen-containing heterocyclic derivative and preparation thereof | 四川海思科制药有限公司 | 2021-05-11 | — | — | CN | disclosed |