Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27659634 | 0.79 | CYP2C19 (0.41) | CYP2C19HSD11B1 | |
| SCHEMBL252668 | 0.77 | EPHX1 (0.35) | EPHX1CYP2C19HSD11B1 | |
| SCHEMBL5183503 | 0.77 | EPHX1 (0.32) | EPHX1CYP2C19HSD11B1 | |
| SCHEMBL5513198 | 0.77 | DGAT1 (0.39) | — | |
| SCHEMBL17818912 | 0.76 | CYP2C19 (0.32) | EPHX1CYP2C19 | |
| SCHEMBL16391193 | 0.74 | PDK1 (0.34) | EPHX1HSD11B1 | |
| SCHEMBL8408705 | 0.72 | DGAT1 (0.36) | CYP2C19 | |
| SCHEMBL5513195 | 0.72 | DGAT1 (0.36) | CYP2C19 | |
| SCHEMBL28053195 | 0.71 | CYP2C19 (0.38) | CYP2C19 | |
| SCHEMBL10405186 | 0.71 | GRM4 (0.36) | CYP2C19HSD11B1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114105807-B | Hydroxycyclohexanamide compound and preparation method and application thereof | 暨南大学 | 2023-08-18 | — | — | CN | claimed |
| CN-114105807-A | Hydroxycyclohexane diamide compound and preparation method and application thereof | 暨南大学 | 2022-03-01 | — | — | CN | claimed |
| CN-114105807-B | Hydroxycyclohexanamide compound and preparation method and application thereof | 暨南大学 | 2023-08-18 | — | — | CN | disclosed |
| CN-114105807-A | Hydroxycyclohexane diamide compound and preparation method and application thereof | 暨南大学 | 2022-03-01 | — | — | CN | disclosed |
| CN-114105807-A | Hydroxycyclohexane diamide compound and preparation method and application thereof | 暨南大学 | 2022-03-01 | — | — | CN | disclosed |