Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 4/20 | 0.64 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL168131 | 0.88 | — | — | |
| Benzylamine SCHEMBL10707644 | 0.80 | LOXL2 (1.00) | LOXL2TAAR1MAOBCYP1A2CYP2D6 | |
| Benzylamine SCHEMBL5481672 | 0.80 | LOXL2 (1.00) | LOXL2TAAR1MAOBCYP1A2CYP2D6 | |
| Benzylamine SCHEMBL373 | 0.80 | — | — | |
| SCHEMBL19242392 | 0.80 | LOXL2 (1.00) | LOXL2TAAR1MAOBCYP1A2CYP2D6 | |
| Benzylamine SCHEMBL1331207 | 0.80 | — | — | |
| Benzylamine SCHEMBL23044734 | 0.77 | LOXL2 (0.93) | LOXL2TAAR1MAOBCYP1A2CYP2D6 | |
| Benzylamine SCHEMBL20357787 | 0.77 | — | — | |
| Benzylamine SCHEMBL424060 | 0.77 | — | — | |
| Benzylamine SCHEMBL4306051 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6054579-A | REACTING A DIFUNCTIONAL COMPONENT CONTAINING AN ACTIVATED CARBON, AN AMINE CAPABLE OF FORMING AN IMINE WITH THE ACTIVATED CARBON, AND AN ISOCYANIDE IN A NUCLEOPHILIC POLAR PROTIC SOLVENT | LEUKOSITE, INC. (US) | 2000-04-25 | — | — | US | disclosed |