Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 3/20 | 0.33 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.32 |
| ▸ | FLT1 | P17948 | 2/20 | 0.32 |
| ▸ | FLT4 | P35916 | 2/20 | 0.32 |
| ▸ | PLK4 | O00444 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
| ▸ | INSR | P06213 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | MARK3 | P27448 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | CLK2 | P49760 | 1/20 | 0.31 |
| ▸ | GSK3A | P49840 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 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 | |
|---|---|---|---|---|
| SCHEMBL4395064 | 0.79 | SMPD3 (0.52) | KDRSMPD3FLT1FLT4PRKAB2 | |
| SCHEMBL15308505 | 0.79 | PDE2A (0.41) | KDRFLT1FLT4PLK4AURKA | |
| SCHEMBL13960990 | 0.76 | KDR (0.37) | KDRFLT1FLT4PLK4AURKA | |
| SCHEMBL25097592 | 0.73 | KDR (0.32) | KDRFLT1FLT4 | |
| SCHEMBL21937291 | 0.72 | KDR (0.31) | KDR | |
| SCHEMBL24767177 | 0.72 | KDM4E (0.43) | CDK2KDM4E | |
| SCHEMBL14142747 | 0.68 | KDR (0.61) | KDRFLT1FLT4PLK4AURKA | |
| SCHEMBL21893829 | 0.68 | SMPD3 (0.48) | KDRSMPD3NOS3NOS2 | |
| Hydrochloric Acid SCHEMBL22835004 | 0.67 | SMPD3 (0.47) | KDRSMPD3NOS3NOS2 | |
| SCHEMBL25469851 | 0.66 | CRHR1 (0.31) | SMPD3 |
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-110818749-B | Method for synthesizing On-DNA aryl sulfonamide compounds in construction of DNA coding compound library | 上海药明康德新药开发有限公司 | 2023-04-07 | — | — | CN | claimed |