Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.87 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.87 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TYR | P14679 | 1/20 | 0.50 |
| ▸ | AR | P10275 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | ESRRG | P62508 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SHBG | P04278 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8031149 | 0.93 | ESR1 (1.00) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| SCHEMBL27277 | 0.93 | ESR1 (1.00) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| Methane SCHEMBL16667289 | 0.91 | ESR1 (0.95) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| Phenol SCHEMBL29851136 | 0.91 | ESR1 (0.95) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| SCHEMBL1456440 | 0.91 | ESR1 (0.70) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| Phenol SCHEMBL8987629 | 0.89 | ESR1 (0.91) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| SCHEMBL30899192 | 0.88 | ESR2 (0.74) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| Bicarbonate SCHEMBL19723102 | 0.87 | ESR1 (0.87) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| SCHEMBL5861516 | 0.87 | ESR1 (0.87) | ESR1ESR2CYP3A4ALDH1A1LMNA | |
| SCHEMBL22336095 | 0.87 | ESR1 (0.87) | ESR1ESR2CYP3A4ALDH1A1LMNA |
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-2021039407-A1 | ACTIVE-RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, PATTERN FORMATION METHOD, AND ELECTRONIC DEVICE MANUFACTURING METHOD | 富士フイルム株式会社 | 2021-03-04 | — | — | WO | disclosed |