Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.47 |
| ▸ | CCR5 | P51681 | 3/20 | 0.47 |
| ▸ | CCR8 | P51685 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.46 |
| ▸ | ALPG | P10696 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL30930809 | 0.94 | CCR1 (0.50) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| SCHEMBL17899680 | 0.94 | CCR1 (0.50) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| SCHEMBL12131380 | 0.89 | CCR1 (0.51) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| SCHEMBL17783303 | 0.85 | CCR1 (0.47) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| SCHEMBL9676963 | 0.85 | CYP1A2 (0.59) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| SCHEMBL7784900 | 0.85 | CYP1A2 (0.59) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| 2-Mercaptoethanol SCHEMBL7785054 | 0.84 | CYP1A2 (0.49) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| 2-Mercaptoethanol SCHEMBL7793761 | 0.84 | CYP1A2 (0.49) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| Hydrochloric Acid SCHEMBL9679292 | 0.84 | CYP1A2 (0.57) | CCR1CCR5CCR8KDM4EHSP90AA1 | |
| SCHEMBL12154044 | 0.83 | PPARA (0.52) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025043301-A1 | METAL-BINDING COMPOUNDS AND METAL COMPLEXES, METHODS OF THEIR PREPARATION, AND USES IN THE COMPLEXING OF METAL IONS | QUEENSLAND UNIVERSITY OF TECHNOLOGY (AU) | 2025-03-06 | — | — | WO | disclosed |