Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | NQO1 | P15559 | 2/20 | 0.41 |
| ▸ | CCNC | P24863 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31371688 | 0.86 | ESR1 (0.61) | ESR1ESR2NQO1CCNCCDK8 | |
| SCHEMBL30876036 | 0.86 | ESR1 (0.61) | ESR1ESR2NQO1CCNCCDK8 | |
| SCHEMBL311076 | 0.86 | ESR1 (0.61) | ESR1ESR2NQO1CCNCCDK8 | |
| SCHEMBL19751374 | 0.80 | TAAR1 (0.44) | ESR1ESR2 | |
| SCHEMBL25751175 | 0.79 | ESR2 (0.48) | ESR1ESR2CCNCCDK8ALDH1A1 | |
| SCHEMBL27652673 | 0.77 | TAAR1 (0.46) | ESR1ESR2ALDH1A1 | |
| SCHEMBL20345259 | 0.77 | ESR1 (0.52) | ESR1ESR2NQO1CCNCCDK8 | |
| SCHEMBL20055631 | 0.77 | ESR1 (0.52) | ESR1ESR2NQO1CCNCCDK8 | |
| SCHEMBL9170762 | 0.77 | TRPA1 (0.43) | ESR1ESR2ALDH1A1KDM4ELMNA | |
| SCHEMBL30702301 | 0.76 | SLC6A4 (0.39) | ESR1ESR2NQO1CYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022097684-A1 | PHOTOSENSITIVE RESIN COMPOSITION, CURED PRODUCT THEREOF AND MULTILAYER MATERIAL | 日本化薬株式会社 | 2022-05-12 | — | — | WO | disclosed |