Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 8/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2205828 | 0.82 | MAPT (0.50) | CYP3A4SMN1; SMN2LMNADRD2DRD4 | |
| SCHEMBL14396803 | 0.79 | HTR2A (0.51) | CYP3A4SMN1; SMN2LMNADRD2DRD4 | |
| SCHEMBL3755105 | 0.76 | CYP3A4 (0.46) | CYP3A4SMN1; SMN2LMNADRD2DRD4 | |
| SCHEMBL27847863 | 0.75 | ACHE (0.40) | CYP3A4SMN1; SMN2LMNAKCNH2HPGD | |
| SCHEMBL177455 | 0.74 | CYP3A4 (0.45) | CYP3A4SMN1; SMN2LMNADRD2DRD4 | |
| SCHEMBL14649910 | 0.74 | HSP90AA1 (0.57) | CYP3A4DRD2DRD4DRD3KCNH2 | |
| SCHEMBL4500324 | 0.74 | DRD2 (0.49) | CYP3A4SMN1; SMN2LMNADRD2DRD4 | |
| SCHEMBL675954 | 0.72 | HTR2A (0.54) | CYP3A4SMN1; SMN2DRD2DRD4DRD3 | |
| SCHEMBL6301020 | 0.72 | NQO1 (0.52) | CYP3A4DRD2DRD4DRD3KCNH2 | |
| SCHEMBL8736417 | 0.72 | TEAD4 (0.48) | CYP3A4SMN1; SMN2DRD2DRD4DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3894402-B1 | N-CONTAINING CHROMEN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION | HOFFMANN LA ROCHE (CH) | 2023-07-05 | — | — | EP | disclosed |