Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 3/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.35 |
| ▸ | CETP | P11597 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9130748 | 0.94 | NISCH (0.35) | SPHK1HTR1AADRA2AADRA2BADRA2C | |
| SCHEMBL9133205 | 0.94 | NISCH (0.35) | SPHK1HTR1AADRA2AADRA2BADRA2C | |
| SCHEMBL9130224 | 0.94 | NISCH (0.35) | SPHK1HTR1AADRA2AADRA2BADRA2C | |
| SCHEMBL6120511 | 0.87 | SPHK2 (0.36) | FAAHFFAR1FFAR4SPHK2SPHK1 | |
| SCHEMBL5831962 | 0.86 | SPHK2 (0.40) | FAAHSPHK2SPHK1CETPMEN1 | |
| SCHEMBL5677029 | 0.85 | SLC6A5 (0.38) | FAAHFFAR1FFAR4MEN1TP53 | |
| SCHEMBL6673295 | 0.84 | FFAR1 (0.40) | FFAR1FFAR4SPHK2SPHK1CETP | |
| SCHEMBL10628299 | 0.84 | FFAR1 (0.40) | FFAR1FFAR4SPHK2SPHK1CETP | |
| SCHEMBL5617189 | 0.84 | FFAR1 (0.40) | FFAR1FFAR4SPHK2SPHK1CETP | |
| SCHEMBL21650618 | 0.84 | NISCH (0.38) | HTR1AADRA2AADRA2BADRA2C |
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-0684223-A1 | Solvent free quaternization of tertiary amines with dimethylsulfate | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-11-29 | — | — | EP | disclosed |
| US-5463094-A | Solvent free quaternization of tertiary amines with dimethylsulfate | HOECHST CELANESE CORPORATION (US) | 1995-10-31 | — | — | US | disclosed |