Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.68 |
| ▸ | GABRA1 | P14867 | 9/20 | 0.66 |
| ▸ | GABRB2 | P47870 | 9/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | CNR2 | P34972 | 3/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | MAPT | P10636 | 2/20 | 0.66 |
| ▸ | CNR1 | P21554 | 2/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | PPARG | P37231 | 2/20 | 0.66 |
| ▸ | PPARD | Q03181 | 2/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.66 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.66 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.66 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.66 |
| ▸ | ESR1 | P03372 | 1/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.61 |
| ▸ | ALOX5 | P09917 | 6/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL219534 | 1.00 | XDH (0.68) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| SCHEMBL4608376 | 0.93 | XDH (0.59) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| Bicarbonate SCHEMBL28309849 | 0.93 | XDH (0.59) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| Phenol SCHEMBL15570258 | 0.90 | XDH (0.56) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| Estragole SCHEMBL1230287 | 0.87 | ALDH1A1 (0.67) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| Methyleugenol SCHEMBL1440046 | 0.86 | ALDH1A1 (0.73) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| SCHEMBL10451531 | 0.84 | XDH (0.68) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| SCHEMBL14368297 | 0.82 | GABRA1 (0.79) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| SCHEMBL2431475 | 0.82 | ESR1 (0.63) | XDHGABRA1GABRB2ALDH1A1CNR2 | |
| Hydroxychavicol SCHEMBL43300 | 0.81 | XDH (1.00) | XDHGABRA1GABRB2ALDH1A1CNR2 |
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-107923120-A | Composition for reducing malodour and use thereof | 阿吉莱克斯香料和香水公司 | 2018-04-17 | — | — | CN | disclosed |