Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | STK17B | O94768 | 1/20 | 0.39 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 4/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 4/20 | 0.38 |
| ▸ | CA9 | Q16790 | 4/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | PRKCB | P05771 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | LYN | P07948 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 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 | |
|---|---|---|---|---|
| SCHEMBL30568519 | 1.00 | DRD2 (0.41) | DRD2DYRK1ABRD4STK17BSTK17A | |
| SCHEMBL25343224 | 0.83 | PRPS1 (0.43) | DRD2DYRK1ABRD4STK17BSTK17A | |
| SCHEMBL25344478 | 0.81 | DYRK1A (0.40) | DRD2DYRK1ABRD4STK17BSTK17A | |
| SCHEMBL25344380 | 0.80 | SSTR4 (0.35) | PDPK1CPB2 | |
| SCHEMBL30568621 | 0.80 | SSTR4 (0.35) | PDPK1CPB2 | |
| SCHEMBL31439941 | 0.80 | MAOA (0.42) | DRD2BRD4CA12CA1CA2 | |
| SCHEMBL25341649 | 0.79 | DRD2 (0.46) | DRD2BRD4CA12CA1CA2 | |
| SCHEMBL30568582 | 0.79 | DYRK1A (0.47) | DRD2DYRK1ABRD4STK17BSTK17A | |
| SCHEMBL25342761 | 0.79 | DYRK1A (0.47) | DRD2DYRK1ABRD4STK17BSTK17A | |
| SCHEMBL31440035 | 0.79 | CAMK2D (0.46) | DRD2DYRK1ABRD4STK17BSTK17A |
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-2023148129-A1 | IMIDAZOLE MACROCYCLES FOR THE TREATMENT OF AUTOIMMUNE DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2023-08-10 | — | — | WO | disclosed |