Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.52 |
| ▸ | ESRRB | O95718 | 4/20 | 0.52 |
| ▸ | HTR6 | P50406 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ESRRG | P62508 | 12/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | ESRRA | P11474 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | GBA1 | P04062 | 1/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | PRKCG | P05129 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL17523674 | 0.80 | ESR1 (0.62) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17524238 | 0.80 | ESR1 (0.57) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17523668 | 0.77 | ESR1 (0.61) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17524237 | 0.77 | ESR1 (0.58) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17524185 | 0.77 | ESR1 (0.58) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17523669 | 0.76 | ESRRB (0.65) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17523650 | 0.75 | ESR1 (0.64) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17523652 | 0.75 | ESR1 (0.58) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17524186 | 0.75 | ESR1 (0.55) | ESR1ESR2ESRRBHTR6LMNA | |
| SCHEMBL17523651 | 0.75 | ESR1 (0.60) | ESR1ESR2ESRRBHTR6LMNA |
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-2016022325-A1 | NOVEL TRIARYLETHYLENE COMPOUNDS AND METHODS USING SAME | THE PENN STATE RESEARCH FOUNDATION (US) | 2016-02-11 | — | — | WO | disclosed |