Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20923146 | 0.97 | GSK3A (0.39) | PDE10AGSK3AGSK3BTRPA1ESR2 | |
| SCHEMBL20923721 | 0.96 | TRPA1 (0.39) | PDE10AGSK3AGSK3BTRPA1ESR2 | |
| SCHEMBL20923147 | 0.94 | PDE10A (0.38) | PDE10AGSK3AGSK3BTRPA1ESR2 | |
| SCHEMBL20923088 | 0.93 | PIK3CA (0.41) | GSK3AGSK3BSMN1; SMN2HIF1ASQOR | |
| SCHEMBL20924129 | 0.93 | TRPA1 (0.41) | PDE10AGSK3AGSK3BTRPA1ESR2 | |
| SCHEMBL19913123 | 0.93 | TRPA1 (0.41) | PDE10AGSK3AGSK3BTRPA1ESR2 | |
| SCHEMBL19909024 | 0.93 | TRPA1 (0.41) | PDE10AGSK3AGSK3BTRPA1ESR2 | |
| SCHEMBL20923190 | 0.91 | AR (0.38) | SMN1; SMN2HIF1ASQORCYP2C19KDM4E | |
| SCHEMBL20924090 | 0.91 | CYP19A1 (0.38) | SQORCYP19A1HPGDCYP1A2CYP2C9 | |
| SCHEMBL19913331 | 0.90 | SQOR (0.40) | PDE10AGSK3AGSK3BTRPA1SMN1; SMN2 |
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-3266772-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-04-24 | — | — | EP | disclosed |