Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28909552 | 1.00 | HRH3 (0.41) | HRH3CYP2D6CYP2C9MAPK1CYP2C19 | |
| SCHEMBL28528284 | 0.90 | CYP2D6 (0.38) | HRH3CYP2D6CYP2C9MAPK1CYP2C19 | |
| SCHEMBL28528279 | 0.90 | CYP2D6 (0.38) | HRH3CYP2D6CYP2C9MAPK1CYP2C19 | |
| SCHEMBL24775580 | 0.86 | HRH3 (0.38) | HRH3CYP2D6CYP2C9MAPK1CYP2C19 | |
| SCHEMBL28529792 | 0.84 | HTR2C (0.41) | CYP2D6CYP2C9MAPK1CYP2C19HTR2B | |
| SCHEMBL28529794 | 0.84 | HTR2C (0.41) | CYP2D6CYP2C9MAPK1CYP2C19HTR2B | |
| SCHEMBL31525091 | 0.84 | HTR2C (0.41) | CYP2D6CYP2C9MAPK1CYP2C19HTR2B | |
| SCHEMBL28532862 | 0.83 | MAPT (0.41) | CYP2D6CYP2C9MAPK1CYP2C19MAPT | |
| SCHEMBL28522991 | 0.82 | RBP4 (0.41) | CYP2D6CYP2C9MAPK1CYP2C19MAPT | |
| SCHEMBL29139927 | 0.82 | MAPT (0.33) | HRH3CYP2D6CYP2C9MAPK1CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117683029-A | Bcl-2 inhibitors | 百济神州有限公司 | 2024-03-12 | — | — | CN | disclosed |
| CN-117430601-A | Bcl-2 inhibitors | 百济神州有限公司 | 2024-01-23 | — | — | CN | disclosed |
| CN-112437772-B | Bcl-2 inhibitors | 百济神州有限公司 | 2023-11-21 | — | — | CN | disclosed |
| CN-112437772-A | Bcl-2 inhibitors | 百济神州有限公司 | 2021-03-02 | — | — | CN | disclosed |