Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.37 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 4/20 | 0.35 |
| ▸ | ACHE | P22303 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PAK4 | O96013 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2706167 | 0.82 | BCHE (0.45) | TBK1IKBKEBCHEACHELMNA | |
| SCHEMBL23033169 | 0.80 | MAOB (0.41) | LMNAMAPTNPC1RAB9AKMT2A | |
| SCHEMBL16806112 | 0.79 | BCHE (0.42) | TBK1IKBKEBCHEACHELMNA | |
| SCHEMBL9980264 | 0.78 | ALDH1A1 (0.45) | TBK1IKBKEBCHEACHELMNA | |
| SCHEMBL23033221 | 0.77 | TBK1 (0.42) | TBK1IKBKELMNAMAPTMEN1 | |
| SCHEMBL21237913 | 0.77 | ROCK2 (0.41) | TBK1IKBKEBCHEACHELMNA | |
| SCHEMBL17033990 | 0.76 | AHR (0.47) | MAPTMEN1NPC1RAB9AKMT2A | |
| SCHEMBL10118784 | 0.75 | TBK1 (0.48) | TBK1IKBKEBCHEACHELMNA | |
| SCHEMBL21237816 | 0.75 | ROCK2 (0.51) | TBK1IKBKEBCHEACHEROCK2 | |
| SCHEMBL23033198 | 0.74 | GABRP (0.35) | LMNAMAPTMEN1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021032209-A1 | ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF | 四川海思科制药有限公司 | 2021-02-25 | — | — | WO | disclosed |