Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 9/20 | 0.76 |
| ▸ | GSK3A | P49840 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | PDE1A | P54750 | 1/20 | 0.40 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 3/20 | 0.39 |
| ▸ | DRD5 | P21918 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30999950 | 0.89 | GSK3B (0.69) | GSK3BGSK3ASRD5A1 | |
| SCHEMBL30999926 | 0.89 | GSK3B (0.69) | GSK3BGSK3ATSHRPDE4APDE4B | |
| SCHEMBL30999985 | 0.81 | GSK3B (0.81) | GSK3BGSK3ATSHRSRD5A1 | |
| SCHEMBL30999966 | 0.75 | GSK3B (0.74) | GSK3BGSK3ASRD5A1 | |
| SCHEMBL30999969 | 0.75 | GSK3B (0.74) | GSK3BGSK3ASRD5A1 | |
| SCHEMBL30999951 | 0.72 | GSK3B (1.00) | GSK3BGSK3ATSHRSRD5A1 | |
| SCHEMBL3822337 | 0.70 | GSK3B (0.69) | GSK3BGSK3ATSHRPDE4B | |
| SCHEMBL4789169 | 0.69 | GSK3B (0.62) | GSK3BGSK3APRKCA | |
| SCHEMBL31000001 | 0.68 | GSK3B (0.83) | GSK3BGSK3ASRD5A1 | |
| SCHEMBL27757915 | 0.67 | DRD1 (0.52) | TSHRDRD1DRD5DRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024163852-A1 | HISTIDINE KINASE INHIBITORS AS ANTIBACTERIAL AGENTS | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2024-08-08 | — | — | WO | claimed |
| WO-2024163852-A1 | HISTIDINE KINASE INHIBITORS AS ANTIBACTERIAL AGENTS | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2024-08-08 | — | — | WO | disclosed |