Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.96 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.60 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | XDH | P47989 | 1/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14679265 | 0.98 | CLK4 (1.00) | CLK4DYRK1ANPC1CYP19A1KDM4E | |
| SCHEMBL30298961 | 0.87 | CLK4 (0.79) | CLK4DYRK1ANPC1CYP19A1KDM4E | |
| SCHEMBL16625771 | 0.81 | CLK4 (0.61) | CLK4DYRK1ANPC1KDM4EALDH1A1 | |
| SCHEMBL2876553 | 0.79 | CLK4 (0.61) | CLK4NPC1KDM4EALDH1A1MAPT | |
| SCHEMBL15896952 | 0.79 | CLK4 (0.61) | CLK4NPC1KDM4EALDH1A1MAPT | |
| SCHEMBL9099848 | 0.79 | CLK4 (0.61) | CLK4DYRK1ANPC1KDM4EALDH1A1 | |
| SCHEMBL9099431 | 0.79 | CLK4 (0.61) | CLK4DYRK1ANPC1KDM4EALDH1A1 | |
| SCHEMBL1335204 | 0.78 | CLK4 (0.67) | CLK4DYRK1ANPC1KDM4EMAPT | |
| SCHEMBL6685962 | 0.78 | CLK4 (0.64) | CLK4DYRK1ANPC1KDM4EALDH1A1 | |
| SCHEMBL6733562 | 0.78 | CA1 (0.79) | CLK4DYRK1ANPC1KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106496127-B | A kind of preparation method of polysubstituted pyrimidine | 苏州大学 | 2019-09-27 | — | — | CN | disclosed |
| CN-106496127-A | A kind of preparation method of polysubstituted pyrimidine | 苏州大学 | 2017-03-15 | — | — | CN | disclosed |