Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL11463024 | 1.00 | ESR1 (0.46) | ESR1TSHRACHEACP3SLC6A2 | |
| SCHEMBL7559113 | 0.85 | GABRA1 (0.44) | ESR1TSHRSLC6A2ELANEALDH1A1 | |
| SCHEMBL9835251 | 0.83 | ADRA2A (0.42) | ESR1TSHRACHESLC6A2ADRA2A | |
| SCHEMBL11441228 | 0.79 | CD44 (0.43) | ESR1TSHRSLC6A2SLC6A4ADRA2A | |
| SCHEMBL9908787 | 0.79 | ALDH1A1 (0.48) | ESR1TSHRSLC6A2GAAELANE | |
| SCHEMBL23249532 | 0.79 | ESR1 (0.48) | ESR1TSHRACHEACP3SLC6A2 | |
| SCHEMBL21331640 | 0.79 | ESR1 (0.48) | ESR1TSHRACHEACP3SLC6A2 | |
| SCHEMBL15914232 | 0.79 | GABRA1 (0.50) | TSHRSLC6A2ELANEALDH1A1GABRA1 | |
| SCHEMBL23249312 | 0.79 | ESR1 (0.48) | ESR1TSHRACHEACP3SLC6A2 | |
| SCHEMBL9165865 | 0.77 | ESR1 (0.46) | ESR1TSHRACHEACP3SLC6A2 |
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-4912274-A | Azaphospholenes and use thereof | STUDIENGESELLSCHAFT KOHLE MBH (DE) | 1990-03-27 | — | — | US | disclosed |