Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 3/20 | 0.31 |
| ▸ | NOS2 | P35228 | 3/20 | 0.31 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL31473484 | 1.00 | CYP1A2 (0.34) | CYP1A2EPHX1PPARGNFKB1NFKB2 | |
| SCHEMBL31473491 | 0.79 | — | — | |
| SCHEMBL3373521 | 0.79 | CYP1A2 (0.41) | CYP1A2EPHX1PPARGNFKB1NFKB2 | |
| SCHEMBL9360168 | 0.77 | CYP1A2 (0.44) | CYP1A2EPHX1PPARGNFKB1NFKB2 | |
| SCHEMBL4197567 | 0.77 | CYP1A2 (0.44) | CYP1A2EPHX1PPARGNFKB1NFKB2 | |
| SCHEMBL8636587 | 0.77 | CYP1A2 (0.44) | CYP1A2EPHX1PPARGNFKB1NFKB2 | |
| SCHEMBL8640860 | 0.77 | CYP1A2 (0.44) | CYP1A2EPHX1PPARGNFKB1NFKB2 | |
| SCHEMBL20477531 | 0.72 | EPHX1 (0.41) | CYP1A2EPHX1PPARGNFKB1NFKB2 | |
| SCHEMBL5408963 | 0.67 | ALDH1A1 (0.54) | CYP1A2EPHX1PPARGALDH1A1 | |
| SCHEMBL11785211 | 0.66 | ALDH1A1 (0.57) | CYP1A2EPHX1PPARGALDH1A1 |
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-119678921-A | Cyclohexene derivative with attraction effect on carpiotosia borer as well as preparation method and application thereof | 华东理工大学 | 2025-03-25 | — | — | CN | disclosed |