Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16192437 | 0.91 | ACHE (0.46) | ESR1PDCD1ESR2CD274CHRNA7 | |
| SCHEMBL17073489 | 0.86 | CYP3A4 (0.41) | ESR1PDCD1ESR2CD274ACHE | |
| SCHEMBL10412646 | 0.86 | ADRB1 (0.50) | ESR1PDCD1ESR2CD274ACHE | |
| SCHEMBL16191280 | 0.86 | ACHE (0.48) | ACHENFE2L2 | |
| SCHEMBL2846227 | 0.85 | LMNA (0.50) | ESR1PDCD1ESR2CD274CHRNA7 | |
| SCHEMBL146509 | 0.84 | ESR1 (0.55) | ESR1PDCD1ESR2CD274CHRNA7 | |
| SCHEMBL13555774 | 0.84 | LMNA (0.35) | ESR1PDCD1ESR2CD274CHRNA7 | |
| Ammonia Solution, Strong SCHEMBL10808062 | 0.83 | LMNA (0.48) | ESR1PDCD1ESR2CD274CHRNA7 | |
| SCHEMBL2210935 | 0.82 | TYR (0.47) | ESR1PDCD1ESR2CD274LMNA | |
| Ammonia Solution, Strong SCHEMBL7995783 | 0.82 | ESR1 (0.52) | ESR1PDCD1ESR2CD274CHRNA7 |
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-4172100-A | 1,3-Bis[1-(4-methylphenyl)ethenyl]benzene | THE DOW CHEMICAL COMPANY (US) | 1979-10-23 | — | — | US | disclosed |