Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.69 |
| ▸ | RB1 | P06400 | 7/20 | 0.51 |
| ▸ | BRD3 | Q15059 | 3/20 | 0.44 |
| ▸ | CDC42 | P60953 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25247033 | 0.92 | CYP2D6 (0.76) | CYP2D6KCNH2RB1BRD3CDC42 | |
| SCHEMBL4196180 | 0.92 | CYP2D6 (0.76) | CYP2D6KCNH2RB1BRD3CDC42 | |
| SCHEMBL30455215 | 0.92 | CYP2D6 (0.76) | CYP2D6KCNH2RB1BRD3CDC42 | |
| SCHEMBL25287616 | 0.92 | CYP2D6 (0.76) | CYP2D6KCNH2RB1BRD3CDC42 | |
| Hydrochloric Acid SCHEMBL4158280 | 0.91 | CYP2D6 (0.74) | CYP2D6KCNH2RB1BRD3CDC42 | |
| SCHEMBL25286477 | 0.83 | CYP2D6 (0.64) | CYP2D6KCNH2RB1BRD3CDC42 | |
| SCHEMBL25249451 | 0.83 | CYP2D6 (0.64) | CYP2D6KCNH2RB1BRD3SIRT2 | |
| SCHEMBL25285965 | 0.83 | CYP2D6 (0.64) | CYP2D6KCNH2RB1BRD3SIRT2 | |
| SCHEMBL25286478 | 0.83 | CYP2D6 (0.64) | CYP2D6KCNH2RB1BRD3CDC42 | |
| SCHEMBL20537339 | 0.82 | CYP2D6 (0.78) | CYP2D6KCNH2RB1BRD3CDC42 |
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-2023121238-A1 | SUBSTITUTED HETEROCYCLIC DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME | (주)메디픽 | 2023-06-29 | — | — | WO | disclosed |