Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 4/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | ESRRB | O95718 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10698635 | 0.85 | ESRRB (0.52) | ESRRBLMNAMAPTESR1ESR2 | |
| SCHEMBL10696281 | 0.85 | ESRRB (0.52) | ESRRBLMNAMAPTESR1ESR2 | |
| SCHEMBL10698084 | 0.83 | MEN1 (0.39) | GBA1BCHEACHEESRRBHTR6 | |
| SCHEMBL8915491 | 0.81 | ESR1 (0.61) | GBA1CYP2D6ESRRBBLMHTR6 | |
| SCHEMBL3781211 | 0.81 | ESR1 (0.61) | GBA1CYP2D6ESRRBBLMHTR6 | |
| SCHEMBL2087896 | 0.81 | ESR1 (0.61) | GBA1CYP2D6ESRRBBLMHTR6 | |
| SCHEMBL10698657 | 0.79 | GBA1 (0.38) | GBA1BCHEACHECYP2D6ESRRB | |
| SCHEMBL2710225 | 0.78 | CYP2D6 (0.55) | GBA1BCHEACHECYP2D6ESRRB | |
| SCHEMBL7929087 | 0.78 | CYP2D6 (0.55) | GBA1BCHEACHECYP2D6ESRRB | |
| SCHEMBL8732737 | 0.78 | CYP2D6 (0.55) | GBA1BCHEACHECYP2D6ESRRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0272330-A1 | 1,1,2-TRIARYL-1-BUTENE DERIVATIVES | TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) | 1988-06-29 | — | — | EP | disclosed |