Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 14/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 12/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.50 |
| ▸ | 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 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SHBG | P04278 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL68287 | 0.93 | ESR1 (0.62) | ESR1ESR2CYP3A4LMNATYR | |
| Methyl Alcohol SCHEMBL28148921 | 0.91 | ESR1 (0.60) | ESR1ESR2CYP3A4LMNATYR | |
| Formaldehyde SCHEMBL5931212 | 0.87 | ESR1 (0.56) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL2139961 | 0.87 | ESR1 (0.59) | ESR1ESR2CYP3A4LMNATYR | |
| Bisphenol A SCHEMBL674171 | 0.87 | ESR1 (0.70) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL23905030 | 0.85 | ESR1 (0.63) | ESR1ESR2CYP3A4LMNATYR | |
| Phenol SCHEMBL8467840 | 0.85 | ESR1 (0.57) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL822723 | 0.85 | ACHE (0.54) | ESR1ESR2CYP3A4LMNATYR | |
| Cyanate SCHEMBL27886623 | 0.83 | ESR1 (0.52) | ESR1ESR2CYP3A4LMNATYR | |
| SCHEMBL28222983 | 0.83 | SHBG (0.57) | ESR1ESR2CYP3A4KIF11LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-112041393-A | Improved flame retardant compositions | 沙特基础工业全球技术公司 | 2020-12-04 | — | — | CN | disclosed |