Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 4/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2169977 | 0.76 | ESR1 (0.48) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL29054459 | 0.75 | NR1H2 (0.45) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL104796 | 0.75 | NR1H2 (0.45) | NR1H2NR1H3ESR1ESR2TSHR | |
| Fluoride SCHEMBL27902337 | 0.71 | NR1H2 (0.42) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL242201 | 0.71 | ESR1 (0.44) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL11023948 | 0.71 | ESR1 (0.44) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL14666537 | 0.69 | ESR1 (0.42) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL10150936 | 0.69 | ESR1 (0.42) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL1053231 | 0.69 | ALDH1A1 (0.41) | NR1H2NR1H3ESR1ESR2TSHR | |
| SCHEMBL1051334 | 0.69 | ALDH1A1 (0.41) | NR1H2NR1H3ESR1ESR2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20220153956-A1 | Polyimide-Gold-Nanorod J-aggregates with Broadened Surface Plasmonic Resonance Band and Method of Manufacture | GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE | 2022-05-19 | — | — | US | disclosed |