Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | DNM1 | Q05193 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.35 |
| ▸ | BAX | Q07812 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28914875 | 1.00 | CYP19A1 (0.46) | CYP19A1DNM1MAPTSMN1; SMN2IDO1 | |
| SCHEMBL24982252 | 0.79 | CYP19A1 (0.40) | CYP19A1DNM1MAPTSMN1; SMN2IDO1 | |
| SCHEMBL31557600 | 0.79 | CYP19A1 (0.40) | CYP19A1DNM1MAPTSMN1; SMN2IDO1 | |
| SCHEMBL15723792 | 0.79 | CYP19A1 (0.48) | CYP19A1DNM1MAPTSMN1; SMN2IDO1 | |
| SCHEMBL28961025 | 0.78 | IDO1 (0.61) | MAPTIDO1LMNAHTTNPSR1 | |
| SCHEMBL31435642 | 0.72 | CYP19A1 (0.44) | CYP19A1MAPTABCC2PDK1CYP3A4 | |
| SCHEMBL29110977 | 0.70 | IDO1 (0.41) | CYP19A1DNM1MAPTSMN1; SMN2IDO1 | |
| SCHEMBL2382103 | 0.70 | PDK1 (0.40) | CYP19A1MAPTABCC2PDK1 | |
| SCHEMBL27738748 | 0.70 | CYP19A1 (0.41) | CYP19A1ABCC2MTNR1AMTNR1BPDK1 | |
| SCHEMBL21088329 | 0.69 | CYP19A1 (0.41) | CYP19A1IDO1MTNR1AMTNR1BPDK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115490628-B | Preparation method of difluoroethanol compound | 五邑大学 | 2024-05-28 | — | — | CN | disclosed |
| CN-115490628-A | Preparation method of difluoroethanol compound | 五邑大学 | 2022-12-20 | — | — | CN | disclosed |