Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | TYR | P14679 | 1/20 | 0.46 |
| ▸ | BID | P55957 | 3/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.45 |
| ▸ | PPARA | Q07869 | 3/20 | 0.45 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.45 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.45 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 2/20 | 0.45 |
| ▸ | EP300 | Q09472 | 1/20 | 0.45 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.45 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.45 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.45 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11042038 | 1.00 | LIPG (0.49) | LIPGCYP3A4TSHRPIK3CATYR | |
| SCHEMBL9330416 | 1.00 | LIPG (0.49) | LIPGCYP3A4TSHRPIK3CATYR | |
| SCHEMBL28222403 | 1.00 | LIPG (0.49) | LIPGCYP3A4TSHRPIK3CATYR | |
| Hydrochloric Acid SCHEMBL28223179 | 0.98 | LIPG (0.47) | LIPGCYP3A4TSHRPIK3CATYR | |
| Hydrochloric Acid SCHEMBL28223099 | 0.98 | LIPG (0.47) | LIPGCYP3A4TSHRPIK3CATYR | |
| Hydrochloric Acid SCHEMBL28223100 | 0.98 | LIPG (0.47) | LIPGCYP3A4TSHRPIK3CATYR | |
| Hydrochloric Acid SCHEMBL28860557 | 0.98 | LIPG (0.47) | LIPGCYP3A4TSHRPIK3CATYR | |
| SCHEMBL10824471 | 0.98 | CYP3A4 (0.48) | LIPGCYP3A4TSHRPIK3CATYR | |
| SCHEMBL9283084 | 0.92 | CYP3A4 (0.50) | LIPGCYP3A4TSHRPIK3CATYR | |
| Hydrochloric Acid SCHEMBL28860471 | 0.91 | CYP3A4 (0.48) | LIPGCYP3A4TSHRPIK3CATYR |
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-104981249-B | Antimicrobe compound, their synthesis and its application | 英国卫生部 | 2018-06-19 | — | — | CN | disclosed |