Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | NOS1 | P29475 | 4/20 | 0.44 |
| ▸ | NOS2 | P35228 | 4/20 | 0.44 |
| ▸ | NOS3 | P29474 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ALPI | P09923 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | XIAP | P98170 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Benzylamine SCHEMBL11588019 | 0.88 | LOXL2 (0.61) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL28273127 | 0.86 | LOXL2 (0.58) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL28273129 | 0.86 | LOXL2 (0.58) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL20593186 | 0.85 | LOXL2 (0.70) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL1256239 | 0.85 | LOXL2 (0.70) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL10635405 | 0.85 | LOXL2 (0.70) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL18138713 | 0.83 | LOXL2 (0.67) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL28115617 | 0.82 | LOXL2 (0.48) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL27128544 | 0.82 | LOXL2 (0.58) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Benzylamine SCHEMBL27390440 | 0.81 | LOXL2 (0.70) | LOXL2CYP2C9CYP2C19CYP2D6CYP1A2 |
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-1049501-A | AZABICYCLO QUINOLONE CARBOXYLIC ACIDS | PFIZER (US) | 1991-02-27 | — | — | CN | disclosed |