Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 18/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29119459 | 0.92 | DRD2 (0.54) | HRH3DRD2KCNH2CYP2D6 | |
| SCHEMBL4768314 | 0.82 | HRH3 (0.56) | HRH3CYP2D6HRH1 | |
| SCHEMBL29119445 | 0.81 | MAPT (0.43) | HRH3DRD2KCNH2CYP2D6 | |
| SCHEMBL3089329 | 0.75 | HRH3 (0.61) | HRH3KCNH2CYP2D6 | |
| SCHEMBL2824273 | 0.74 | HRH3 (0.56) | HRH3DRD2CYP2D6 | |
| SCHEMBL2821270 | 0.74 | HRH3 (0.56) | HRH3CYP2D6 | |
| SCHEMBL1788210 | 0.74 | HRH3 (0.56) | HRH3CYP2D6 | |
| SCHEMBL2821268 | 0.74 | HRH3 (0.56) | HRH3CYP2D6 | |
| SCHEMBL1787634 | 0.74 | HRH3 (0.54) | HRH3CYP2D6 | |
| SCHEMBL1953271 | 0.73 | HRH3 (0.49) | HRH3DRD2KCNH2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116888127-A | Tri-fused ring HPK1 inhibitor and application thereof | 轩竹生物科技股份有限公司 | 2023-10-13 | — | — | CN | disclosed |
| WO-2022188823-A1 | TRICYCLIC HPK1 INHIBITOR AND USE THEREOF | 山东轩竹医药科技有限公司 | 2022-09-15 | — | — | WO | disclosed |