Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 13/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.57 |
| ▸ | AR | P10275 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9449506 | 0.86 | CYP1A2 (0.50) | ESR1ESR2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4698484 | 0.83 | CYP1A2 (0.46) | ESR1ESR2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9007994 | 0.82 | ESR1 (0.59) | ESR1ESR2ARPDE10A | |
| SCHEMBL589455 | 0.81 | ESR1 (0.59) | ESR1ESR2ARCYP1A2CYP2C9 | |
| SCHEMBL31717175 | 0.81 | ESR1 (0.59) | ESR1ESR2ARCYP1A2CYP2C9 | |
| SCHEMBL69287 | 0.78 | KIF11 (0.54) | ESR1ESR2CYP1A2CYP2C9CYP2C19 | |
| Ethane SCHEMBL28242861 | 0.78 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19CYP19A1KIF11 | |
| SCHEMBL126749 | 0.78 | CYP2C9 (0.58) | CYP1A2CYP2C9CYP2C19CYP19A1KIF11 | |
| Phenol SCHEMBL28598393 | 0.76 | CYP1A2 (0.54) | ESR1ESR2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9972713 | 0.75 | ESR1 (0.46) | ESR1ESR2KIF11 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2516501-A1 | METHODS FOR THE PREPARATION OF A POLY(ARYLENE ETHER) POLYSILOXANE MULTIBLOCK COPOLYMER | SABIC Innovative Plastics IP B.V. (NL) | 2012-10-31 | — | — | EP | disclosed |
| WO-2011077297-A1 | METHODS FOR THE PREPARATION OF A POLY(ARYLENE ETHER) POLYSILOXANE MULTIBLOCK COPOLYMER | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2011-06-30 | — | — | WO | disclosed |