Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 16/20 | 0.37 |
| ▸ | BRD2 | P25440 | 6/20 | 0.37 |
| ▸ | BRD3 | Q15059 | 6/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| SCHEMBL29947992 | 1.00 | BRD4 (0.37) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL28682520 | 0.89 | BRD4 (0.39) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL28668128 | 0.79 | GPR119 (0.39) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL29948011 | 0.79 | GPR119 (0.39) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL28672015 | 0.68 | NR3C1 (0.42) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL29948131 | 0.67 | BRD4 (0.40) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL28666656 | 0.67 | BRD4 (0.40) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL16896894 | 0.65 | GPR119 (0.42) | BRD4GPR119 | |
| SCHEMBL16905852 | 0.65 | CYP3A4 (0.43) | BRD4BRD2BRD3CYP3A4CYP2C9 | |
| SCHEMBL29619054 | 0.63 | GPR119 (0.45) | GPR119 |
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-113896725-B | Pyrazoloquinoline compound and preparation method and application thereof | 沈阳药科大学 | 2022-10-25 | — | — | CN | disclosed |
| CN-113896725-A | Pyrazoloquinoline compound and preparation method and application thereof | 沈阳药科大学 | 2022-01-07 | — | — | CN | disclosed |