Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 13/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 10/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | ESRRG | P62508 | 1/20 | 0.42 |
| ▸ | SHBG | P04278 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | TACR2 | P21452 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11795050 | 0.93 | ESR1 (0.47) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8064735 | 0.89 | ESR1 (0.47) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2980562 | 0.86 | ESR1 (0.50) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6440889 | 0.83 | ESR1 (0.47) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6057016 | 0.81 | POLB (0.38) | ESR2CYP3A4HSD17B10ALDH1A1MEN1 | |
| SCHEMBL7202909 | 0.81 | ESR1 (0.48) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL278572 | 0.79 | ESR1 (0.47) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10148035 | 0.79 | ESR1 (0.47) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL278764 | 0.79 | ESR1 (0.47) | ESR1ESR2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11213618 | 0.79 | GAA (0.41) | ESR1ESR2HSD17B10ARHPGD |
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-116858979-B | Method and system for monitoring nonylphenol pollutants | 广东工业大学 | 2024-06-07 | — | — | CN | disclosed |
| CN-116858979-A | Method and system for monitoring nonylphenol pollutants | 广东工业大学 | 2023-10-10 | — | — | CN | disclosed |