Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | HRH1 | P35367 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | BRD2 | P25440 | 1/20 | 0.30 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1503455 | 0.79 | ESR1 (0.41) | ESR1ESR2HTR2AHRH1ALDH1A1 | |
| SCHEMBL22200163 | 0.79 | ESR1 (0.41) | ESR1ESR2HTR2AHRH1ALDH1A1 | |
| SCHEMBL28274239 | 0.75 | ESR1 (0.34) | ESR1ESR2ALDH1A1TSHRNR1I2 | |
| SCHEMBL29552450 | 0.73 | TAAR1 (0.38) | ESR1ESR2HTR2AHRH1ALDH1A1 | |
| SCHEMBL26361047 | 0.73 | KMT2A (0.39) | ESR1ESR2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL20499845 | 0.71 | MAPT (0.36) | ESR1ESR2HTR2AHRH1ALDH1A1 | |
| SCHEMBL1526078 | 0.71 | ESR1 (0.35) | ESR1ESR2ALDH1A1TSHRKCNN4 | |
| Formaldehyde SCHEMBL28845505 | 0.70 | ESR1 (0.42) | ESR1ESR2ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL1203911 | 0.69 | ESR1 (0.41) | ESR1ESR2HTR2AHRH1ALDH1A1 | |
| SCHEMBL15166741 | 0.69 | ESR1 (0.41) | ESR1ESR2HTR2AHRH1ALDH1A1 |
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-105683203-B | Vinylsilanes for use in functionalized elastomeric polymers | 盛禧奥欧洲有限责任公司 | 2019-03-15 | — | — | CN | disclosed |