Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 6/20 | 0.35 |
| ▸ | CDK2 | P24941 | 6/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CCND1 | P24385 | 1/20 | 0.33 |
| ▸ | CDK7 | P50613 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26066975 | 0.79 | ADORA2A (0.41) | CDK2GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL23367933 | 0.79 | ALDH1A1 (0.42) | CCNE1CDK2CDK5CCNT1ALDH1A1 | |
| SCHEMBL26066988 | 0.72 | ALDH1A1 (0.54) | CCNE1CDK2CDK5GABRA1ALDH1A1 | |
| SCHEMBL1315744 | 0.72 | CYP2A6 (0.41) | GABRG2GABRB3GABRA5GABRA3GABRA1 | |
| SCHEMBL2818608 | 0.71 | HPGDS (0.54) | CYP2D6ALDH1A1SMN1; SMN2 | |
| SCHEMBL2819462 | 0.69 | ALDH1A1 (0.47) | CCNE1CDK2CDK5CCNT1ALDH1A1 | |
| SCHEMBL23367916 | 0.69 | KDM4E (0.46) | SMN1; SMN2 | |
| SCHEMBL15624391 | 0.69 | TDP1 (0.44) | CYP2D6GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL26051056 | 0.68 | CCNE1 (0.34) | CCNE1CDK2CDK5CCNT1ALDH1A1 | |
| SCHEMBL30482478 | 0.67 | BACE1 (0.41) | GABRG2GABRB3GABRA5GABRA3GABRA1 |
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-2023164234-A1 | COMPOUNDS AND METHODS USEFUL FOR STABILIZING PHENYLALANINE HYDROXYLASE MUTATIONS | AGIOS PHARMACEUTICALS, INC. (US) | 2023-08-31 | — | — | WO | disclosed |
| WO-2023164237-A1 | COMPOUNDS AND METHODS USEFUL FOR STABILIZING PHENYLALANINE HYDROXYLASE MUTATIONS | AGIOS PHARMACEUTICALS, INC. (US) | 2023-08-31 | — | — | WO | disclosed |