Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 2/20 | 0.44 |
| ▸ | HTR6 | P50406 | 5/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29790245 | 0.83 | KDM4E (0.44) | ADRB1HTR6CHEK1DRD2DRD3 | |
| SCHEMBL22912708 | 0.83 | PARP1 (0.49) | ADRB1CHEK1BACE1 | |
| SCHEMBL29396740 | 0.83 | PARP1 (0.49) | ADRB1CHEK1BACE1 | |
| SCHEMBL22912710 | 0.83 | KDM4E (0.44) | ADRB1HTR6CHEK1DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL26596749 | 0.82 | PARP1 (0.48) | CHEK1BACE1 | |
| SCHEMBL29203525 | 0.80 | HSP90AA1 (0.47) | DRD2DRD3BACE1HTR2CHTR1A | |
| SCHEMBL31465719 | 0.80 | HSD11B1 (0.43) | CHEK1BACE1 | |
| SCHEMBL31159500 | 0.80 | PARP1 (0.43) | CHEK1BACE1 | |
| Hydrochloric Acid SCHEMBL31552852 | 0.79 | HSP90AA1 (0.47) | DRD2DRD3HTR2CHTR1ADRD4 | |
| Hydrochloric Acid SCHEMBL31552854 | 0.79 | SMYD3 (0.43) | CHEK1BACE1 |
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-2023232069-A1 | AZAQUINOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF | 成都苑东生物制药股份有限公司 | 2023-12-07 | — | — | WO | disclosed |