Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 19/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.42 |
| ▸ | MAP3K6 | O95382 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19013519 | 0.81 | TGFBR1 (0.44) | TGFBR1 | |
| SCHEMBL28848741 | 0.77 | MAP3K5 (0.46) | MAP3K5MAP3K6 | |
| SCHEMBL28848874 | 0.75 | GSK3B (0.41) | MAP3K5TGFBR1 | |
| SCHEMBL29394473 | 0.74 | LCK (0.47) | — | |
| SCHEMBL18989735 | 0.73 | TGFBR1 (0.39) | TGFBR1 | |
| SCHEMBL13488656 | 0.72 | CDK5 (0.52) | — | |
| SCHEMBL31105914 | 0.72 | GAA (0.40) | TGFBR1 | |
| SCHEMBL3199360 | 0.71 | CLK2 (0.51) | — | |
| SCHEMBL9005360 | 0.71 | CKS1B (0.44) | — | |
| SCHEMBL16790987 | 0.71 | KIF18A (0.53) | — |
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-110036005-B | Amide derivatives and their use in medicine | 广东东阳光药业有限公司 | 2022-09-27 | — | — | CN | disclosed |