Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL4907419 | 1.00 | DGAT1 (0.36) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL4939145 | 0.86 | DGAT1 (0.40) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL28195825 | 0.86 | DGAT1 (0.40) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL9116850 | 0.86 | DGAT1 (0.40) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL25436173 | 0.82 | DGAT1 (0.38) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL2330290 | 0.82 | DGAT1 (0.38) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL30185755 | 0.82 | DGAT1 (0.38) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL28815007 | 0.81 | DGAT1 (0.36) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL1536326 | 0.79 | DGAT1 (0.39) | DGAT1CYP1A2CYP2D6 | |
| SCHEMBL27797420 | 0.79 | DGAT1 (0.35) | DGAT1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107586265-A | A kind of acid compounds of diaminourea two, its preparation method and its application of the orthogonal protection of environment-friendly type | 合肥工业大学 | 2018-01-16 | — | — | CN | disclosed |