Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WEE1 | P30291 | 1/20 | 0.38 |
| ▸ | EED | O75530 | 1/20 | 0.35 |
| ▸ | SETD2 | Q9BYW2 | 4/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20648809 | 1.00 | WEE1 (0.38) | WEE1EEDSETD2NSD2SSTR2 | |
| SCHEMBL24722991 | 0.89 | L3MBTL3 (0.37) | WEE1SETD2SSTR2HRH3L3MBTL3 | |
| SCHEMBL20180500 | 0.85 | SETD2 (0.40) | WEE1EEDSETD2NSD2SSTR2 | |
| SCHEMBL20374347 | 0.83 | HSD11B1 (0.34) | L3MBTL3KCNH2CYP2D6HRH1LCK | |
| SCHEMBL20648820 | 0.82 | WEE1 (0.38) | WEE1EEDSETD2NSD2L3MBTL3 | |
| SCHEMBL24722945 | 0.80 | MAP4K4 (0.41) | HRH3CYP11B1CYP11B2MAP4K4 | |
| SCHEMBL21964835 | 0.80 | EED (0.36) | WEE1EEDSETD2NSD2L3MBTL3 | |
| SCHEMBL24349162 | 0.79 | EED (0.36) | WEE1EEDSETD2NSD2L3MBTL3 | |
| SCHEMBL24328559 | 0.77 | PRKCZ (0.32) | WEE1EEDSETD2NSD2L3MBTL3 | |
| SCHEMBL30962943 | 0.77 | ALDH1A1 (0.41) | WEE1SETD2NSD2 |
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-110914277-B | Imidazo [1,2-b ] pyrimido [4,5-d ] pyridazin-5 (6H) -one compounds and application thereof | 上海瑛派药业有限公司 | 2022-08-09 | — | — | CN | disclosed |