Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 8/20 | 0.39 |
| ▸ | DRD3 | P35462 | 4/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9152812 | 0.88 | EPHX1 (0.47) | HSD17B10DRD4CYP1A2 | |
| SCHEMBL6966556 | 0.87 | HSD17B10 (0.47) | HSD17B10DRD4DRD3DRD2CCR2 | |
| SCHEMBL28864592 | 0.81 | HSD17B10 (0.48) | HSD17B10DRD4DRD3DRD2PDK1 | |
| SCHEMBL169122 | 0.81 | HSD17B10 (0.48) | HSD17B10DRD4DRD3DRD2PDK1 | |
| SCHEMBL9281464 | 0.81 | HSD17B10 (0.54) | HSD17B10DRD4DRD3DRD2 | |
| SCHEMBL22463771 | 0.79 | HRH3 (0.43) | DRD4DRD3DRD2CYP1A2CYP3A4 | |
| SCHEMBL20750562 | 0.78 | DRD3 (0.43) | DRD4DRD3DRD2CYP1A2CYP3A4 | |
| SCHEMBL24508741 | 0.78 | DRD3 (0.46) | DRD4DRD3DRD2CYP1A2CYP3A4 | |
| SCHEMBL18531912 | 0.77 | CCR2 (0.40) | HSD17B10DRD4DRD3DRD2CYP1A2 | |
| SCHEMBL715037 | 0.76 | HSD17B10 (0.50) | HSD17B10KCNH2PDK1 |
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-2021078073-A1 | N-CONTAINING DERIVATIVE OF SUBSTITUTED PHENOL HYDROXY ACID ESTER, AND PREPARATION AND USE THEREOF | 四川大学华西医院 | 2021-04-29 | — | — | WO | disclosed |