Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | OGA | O60502 | 1/20 | 0.39 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | EPAS1 | Q99814 | 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 | |
|---|---|---|---|---|
| SCHEMBL28630081 | 0.88 | DGAT1 (0.45) | CNR1DGAT1KMT2AHRH3RIPK1 | |
| SCHEMBL28624625 | 0.84 | GAA (0.47) | CNR1GAACYP2C9HIF1AEPAS1 | |
| SCHEMBL28624609 | 0.80 | SCN9A (0.48) | GAACYP2C9KMT2AERAP2ERAP1 | |
| SCHEMBL23619094 | 0.80 | ROCK2 (0.44) | — | |
| SCHEMBL28629242 | 0.78 | CYP2C9 (0.50) | CNR1GAACYP2C9HIF1AEPAS1 | |
| SCHEMBL24890843 | 0.77 | CYP2C9 (0.52) | CYP2C9DGAT1RXFP1KMT2A | |
| SCHEMBL26429621 | 0.74 | HDAC1 (0.50) | CYP2C9RXFP1KMT2A | |
| SCHEMBL23619018 | 0.74 | RORC (0.41) | — | |
| SCHEMBL28629897 | 0.74 | CYP2C9 (0.50) | GAACYP2C9KMT2AERAP2ERAP1 | |
| SCHEMBL3625051 | 0.73 | NR1H3 (0.58) | DGAT1FAAH |
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-113121463-A | Amide compound with bicyclic structure and application thereof in medicines | 广东东阳光药业有限公司 | 2021-07-16 | — | — | CN | disclosed |