Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.62 |
| ▸ | HTR2A | P28223 | 4/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CETP | P11597 | 1/20 | 0.45 |
| ▸ | TLR2 | O60603 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| 4-Phenyl-Butylamine SCHEMBL8103485 | 0.95 | MAOA (0.66) | MAOAHTR2ASIGMAR1KCNH2CYP2A6 | |
| 4-Phenyl-Butylamine SCHEMBL8356098 | 0.93 | MAOA (0.63) | MAOAHTR2AKCNH2 | |
| 4-Phenyl-Butylamine SCHEMBL8353115 | 0.93 | MAOA (0.63) | MAOAHTR2AKCNH2 | |
| SCHEMBL9158637 | 0.93 | MAOA (0.62) | MAOAHTR2ASIGMAR1KCNH2CYP2A6 | |
| Hydrocinnamyl Alcohol SCHEMBL27568691 | 0.91 | TDP1 (0.56) | MAOASIGMAR1KCNH2LTA4HEPHX2 | |
| 4-Phenyl-Butylamine SCHEMBL8343768 | 0.89 | MAOA (0.79) | MAOAHTR2ASIGMAR1KCNH2CYP2A6 | |
| 4-Phenyl-Butylamine SCHEMBL9373863 | 0.89 | MAOA (0.79) | MAOAHTR2ASIGMAR1KCNH2CYP2A6 | |
| Monoethanolamine SCHEMBL11429253 | 0.87 | HTR2A (0.63) | MAOAHTR2ASIGMAR1KCNH2 | |
| SCHEMBL9156243 | 0.85 | MAOA (0.55) | MAOAHTR2ASIGMAR1LTA4HEPHX2 | |
| Hexadecylamine SCHEMBL5181808 | 0.85 | MAOA (0.67) | MAOAHTR2ASIGMAR1KCNH2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103998502-B | Nano composite material | 道达尔研究技术弗吕公司 | 2016-09-21 | — | — | CN | disclosed |