Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 5/20 | 0.35 |
| ▸ | MAOA | P21397 | 4/20 | 0.35 |
| ▸ | MAOB | P27338 | 4/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 5/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 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 | |
|---|---|---|---|---|
| SCHEMBL9130224 | 1.00 | NISCH (0.35) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL9130748 | 1.00 | NISCH (0.35) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL9130846 | 0.94 | FAAH (0.35) | ADRA2AADRA2BADRA2CHTR1ASPHK1 | |
| SCHEMBL21226062 | 0.89 | NISCH (0.38) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL18612770 | 0.89 | NISCH (0.38) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL21650618 | 0.89 | NISCH (0.38) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL9131848 | 0.85 | LMNA (0.35) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL11693643 | 0.85 | LMNA (0.39) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL3930738 | 0.85 | LMNA (0.35) | NISCHMAOAMAOBADRA2AADRA2B | |
| SCHEMBL10576271 | 0.85 | MEN1 (0.34) | NISCHMAOAMAOBADRA2AADRA2B |
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 |