Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | VCP | P55072 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 5/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17713470 | 0.85 | PARP1 (0.34) | PARP1DAO | |
| SCHEMBL9818295 | 0.82 | PTPRC (0.33) | FAAH | |
| SCHEMBL30260017 | 0.82 | KDM4E (0.45) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL584658 | 0.82 | DAO (0.45) | MAOBMAOAALDH1A1DAO | |
| SCHEMBL2432440 | 0.82 | KDM4E (0.45) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL1257233 | 0.78 | DAO (0.49) | DAO | |
| SCHEMBL1151214 | 0.78 | DAO (0.46) | PARP1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL318590 | 0.76 | ADH1B (0.46) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL4444493 | 0.76 | CYP1A2 (0.46) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL1363945 | 0.76 | TAAR1 (0.52) | PARP1KDM4ECYP1A2CYP2D6CYP2C9 |
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-0308808-B1 | PROCESS FOR THE PREPARATION OF 2-FLUORO-5-ALLYL-DIPHENYL ETHERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-12-18 | — | — | EP | disclosed |
| EP-0308808-A1 | Process for the preparation of 2-fluoro-5-allyl-diphenyl ethers | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-03-29 | — | — | EP | disclosed |