Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28006955 | 0.90 | MEN1 (0.42) | ALDH1A1L3MBTL1POLBTDP1ESR1 | |
| SCHEMBL28007004 | 0.90 | ALDH1A1 (0.39) | TRPA1ALDH1A1KDM4EL3MBTL1POLB | |
| SCHEMBL28006996 | 0.81 | RARB (0.39) | ALDH1A1KDM4EL3MBTL1PPARG | |
| SCHEMBL28006623 | 0.81 | ALDH1A1 (0.38) | ALDH1A1KDM4EL3MBTL1POLBRECQL | |
| SCHEMBL28006638 | 0.80 | MEN1 (0.40) | ALDH1A1L3MBTL1POLBTDP1ESR1 | |
| Phenylpropanol SCHEMBL28124279 | 0.80 | LMNA (0.54) | ALDH1A1KDM4EL3MBTL1POLBRECQL | |
| Benzene SCHEMBL27546363 | 0.78 | KDM4E (0.55) | ALDH1A1KDM4ETDP1ESR1TSHR | |
| SCHEMBL27356485 | 0.77 | ACE2 (0.43) | ALDH1A1KDM4EL3MBTL1POLBRECQL | |
| Butane SCHEMBL27422579 | 0.76 | TSHR (0.47) | ALDH1A1KDM4EL3MBTL1POLBRECQL | |
| Alcohol SCHEMBL27614988 | 0.76 | TSHR (0.47) | ALDH1A1KDM4EL3MBTL1POLBRECQL |
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-107208120-A | Rapid pretreatment | 斯威特沃特能源公司 | 2017-09-26 | — | — | CN | disclosed |
| CN-104428421-A | Process for using tobacco | KIND CONSUMER LTD | 2015-03-18 | — | — | CN | disclosed |