Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP24A1 | Q07973 | 8/20 | 0.52 |
| ▸ | CYP27A1 | Q02318 | 3/20 | 0.52 |
| ▸ | CYP26A1 | O43174 | 4/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | METAP1 | P53582 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28501373 | 0.90 | CYP19A1 (0.47) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL630429 | 0.85 | CYP24A1 (0.57) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL28728851 | 0.81 | MAOB (0.52) | CYP24A1CYP27A1ALDH1A1 | |
| SCHEMBL28496488 | 0.78 | CYP19A1 (0.38) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL28500672 | 0.77 | TYMS (0.39) | CYP19A1 | |
| SCHEMBL28506308 | 0.77 | NQO2 (0.36) | CYP19A1ACHEALDH1A1 | |
| SCHEMBL28500637 | 0.77 | CYP19A1 (0.42) | CYP19A1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL28507951 | 0.75 | ACHE (0.43) | METAP1ACHEALDH1A1 | |
| SCHEMBL13039619 | 0.75 | DRD2 (0.60) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL28729754 | 0.75 | MAPT (0.50) | CYP19A1DRD2ACHEALDH1A1 |
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-110003187-B | Polyfluoroalkyl substituted benzofuran compound and preparation method thereof | 南京工业大学 | 2021-11-05 | — | — | CN | claimed |
| CN-110003187-A | Polyfluoroalkyl substituted benzofuran compound and preparation method thereof | 南京工业大学 | 2019-07-12 | — | — | CN | claimed |
| CN-110003187-B | Polyfluoroalkyl substituted benzofuran compound and preparation method thereof | 南京工业大学 | 2021-11-05 | — | — | CN | disclosed |
| CN-110003187-A | Polyfluoroalkyl substituted benzofuran compound and preparation method thereof | 南京工业大学 | 2019-07-12 | — | — | CN | disclosed |