Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28976304 | 1.00 | PDK1 (0.41) | PDK1KDM1ADRD1GLRA1DRD3 | |
| SCHEMBL15329917 | 0.89 | PDK1 (0.35) | PDK1KDM1A | |
| SCHEMBL16877209 | 0.82 | PDK1 (0.42) | PDK1KDM1ADRD1DRD3 | |
| SCHEMBL2562460 | 0.81 | KDM1A (0.43) | PDK1KDM1ADRD1GLRA1DRD3 | |
| SCHEMBL4447538 | 0.81 | DRD3 (0.30) | DRD3 | |
| Hydrochloric Acid SCHEMBL25293658 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL318921 | 0.79 | — | — | |
| Bromide SCHEMBL28935807 | 0.79 | DRD3 (0.43) | PDK1KDM1ADRD1DRD3 | |
| SCHEMBL15820207 | 0.77 | DRD3 (0.33) | DRD3 | |
| SCHEMBL20570593 | 0.77 | DRD3 (0.30) | DRD3 |
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-115244047-A | Indazole derivative and application thereof in medicine | 四川海思科制药有限公司 | 2022-10-25 | — | — | CN | disclosed |