Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | ICMT | O60725 | 2/20 | 0.38 |
| ▸ | ALB | P02768 | 2/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31010291 | 1.00 | NPC1 (0.41) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL29969282 | 1.00 | NPC1 (0.41) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25229294 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25227860 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25224460 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25276956 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25226812 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25270420 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25278096 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 | |
| SCHEMBL25224466 | 0.83 | NPC1 (0.53) | NPC1JAK2RAB9APAX8KCNH2 |
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-115279773-A | Novel borate compound-containing compositions | ＡＧＣ株式会社 | 2022-11-01 | — | — | CN | disclosed |