Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.34 |
| ▸ | FLT4 | P35916 | 7/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 4/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.33 |
| ▸ | CDK2 | P24941 | 3/20 | 0.33 |
| ▸ | CDK1 | P06493 | 2/20 | 0.33 |
| ▸ | CDK4 | P11802 | 2/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.33 |
| ▸ | CCND1 | P24385 | 2/20 | 0.33 |
| ▸ | CCND3 | P30281 | 2/20 | 0.33 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.32 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.32 |
| ▸ | MERTK | Q12866 | 1/20 | 0.32 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31150035 | 0.92 | CDK2 (0.35) | MAP3K5FLT4IRAK4ALKCCNE1 | |
| SCHEMBL29646043 | 0.88 | BRD4 (0.39) | ALKP2RX7 | |
| SCHEMBL29645600 | 0.87 | PDK2 (0.32) | P2RX7 | |
| SCHEMBL29645908 | 0.87 | RIPK1 (0.33) | PIK3CASCN9AP2RX7 | |
| SCHEMBL29645878 | 0.86 | HSP90AA1 (0.35) | SCN9AP2RX7 | |
| SCHEMBL29645992 | 0.86 | P2RX7 (0.31) | PIK3CAP2RX7 | |
| SCHEMBL29646080 | 0.86 | MAPT (0.40) | ALK | |
| SCHEMBL29645911 | 0.86 | CLK2 (0.33) | ALKCDK4CCND1CCND3MET | |
| SCHEMBL29645523 | 0.85 | BRD4 (0.36) | PIK3CA | |
| SCHEMBL29645682 | 0.83 | ADORA3 (0.40) | P2RX7 |
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-114466850-A | [1,2,4] triazolo [1,5-C ] quinazolin-5-amines | 拜耳股份有限公司 | 2022-05-10 | — | — | CN | claimed |