Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 8/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 8/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 5/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.38 |
| ▸ | MAP3K5 | Q99683 | 3/20 | 0.38 |
| ▸ | RIPK2 | O43353 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29949355 | 1.00 | CHRNB2 (0.38) | CHRNB2CHRNA4CHRNB4CHRNA3MAP3K5 | |
| SCHEMBL29949305 | 0.82 | MAP3K5 (0.38) | MAP3K5RIPK2 | |
| SCHEMBL28848739 | 0.82 | MAP3K5 (0.38) | MAP3K5RIPK2 | |
| SCHEMBL25316841 | 0.79 | MAP3K5 (0.47) | MAP3K5NPC1RAB9ANLRP3DDB1 | |
| SCHEMBL30352583 | 0.79 | MAP3K5 (0.47) | MAP3K5NPC1RAB9ANLRP3DDB1 | |
| SCHEMBL25316032 | 0.78 | NPC1 (0.53) | MAP3K5NPC1RAB9ANLRP3DDB1 | |
| SCHEMBL14299557 | 0.74 | CYP2E1 (0.54) | CHRNB2CHRNA4CHRNB4CHRNA3NPC1 | |
| SCHEMBL21461042 | 0.73 | MAP3K5 (0.42) | MAP3K5 | |
| SCHEMBL20259967 | 0.73 | RIPK2 (0.46) | RIPK2 | |
| SCHEMBL28848700 | 0.70 | MAP3K5 (0.35) | MAP3K5NPC1RAB9ANLRP3 |
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-110036005-B | Amide derivatives and their use in medicine | 广东东阳光药业有限公司 | 2022-09-27 | — | — | CN | disclosed |