Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29406921 | 0.84 | ALDH1A1 (0.46) | CYP1A2CYP3A4CYP2D6CYP2C19LOXL2 | |
| SCHEMBL39710 | 0.84 | ALDH1A1 (0.46) | CYP1A2CYP3A4CYP2D6CYP2C19LOXL2 | |
| Iodide SCHEMBL31233435 | 0.82 | ALDH1A1 (0.44) | CYP1A2CYP3A4CYP2D6CYP2C19LOXL2 | |
| SCHEMBL24465564 | 0.76 | LOXL2 (0.54) | KIF11TSHRLOXL2TAAR1RET | |
| SCHEMBL27925716 | 0.74 | KDM4E (0.54) | CYP1A2CYP3A4CYP2D6LMNAALDH1A1 | |
| Benzylamine SCHEMBL893344 | 0.73 | LOXL2 (0.70) | CYP1A2CYP2D6CYP2C19KIF11TSHR | |
| SCHEMBL10788244 | 0.71 | TSHR (0.54) | TSHRLMNAHTTALDH1A1NPC1 | |
| SCHEMBL18934330 | 0.71 | HTR7 (0.47) | LOXL2TAAR1CSNK2A1CSNK2A2CSNK2B | |
| SCHEMBL27907605 | 0.70 | MAOB (0.56) | TAAR1HTR2A | |
| Ethylamine SCHEMBL4252037 | 0.70 | HTR2A (0.50) | TSHRRETHTR2ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103140211-B | Skin care compositions comprising substituted monoamines | UNILEVER PLC | 2015-05-27 | — | — | CN | disclosed |
| CN-103140211-A | Skin care compositions comprising substituted monoamines | UNILEVER PLC | 2013-06-05 | — | — | CN | disclosed |