Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 5/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 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 | |
|---|---|---|---|---|
| SCHEMBL1229572 | 0.86 | HRH1 (0.47) | EPHX2HRH3 | |
| Hydrochloric Acid SCHEMBL71850 | 0.84 | HRH1 (0.46) | EPHX2HRH3 | |
| SCHEMBL19294270 | 0.82 | PTGS1 (0.48) | PDK2EPHX2PTGS1PTGS2FFAR4 | |
| SCHEMBL29890071 | 0.81 | KDM1A (0.40) | ARACACB | |
| SCHEMBL26933273 | 0.81 | KDM1A (0.40) | ARACACB | |
| SCHEMBL15477158 | 0.81 | KDM1A (0.40) | ARACACB | |
| SCHEMBL15477156 | 0.81 | KDM1A (0.40) | ARACACB | |
| SCHEMBL17012836 | 0.80 | PTGS1 (0.51) | PDK2PTGS1PTGS2FFAR4PARP10 | |
| Hydrochloric Acid SCHEMBL9277795 | 0.80 | KDM1A (0.39) | ARACACB | |
| Hydrochloric Acid SCHEMBL30636296 | 0.80 | KDM1A (0.39) | ARACACB |
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-117062804-A | 1, 3-substituted cyclobutyl derivatives and their use | 诺华股份有限公司 | 2023-11-14 | — | — | CN | disclosed |