Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 3/20 | 0.42 |
| ▸ | RARG | P13631 | 3/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 6/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 2/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.35 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL23011982 | 0.83 | MAP3K5 (0.45) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL17276170 | 0.80 | MAP3K5 (0.43) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL17276293 | 0.76 | HDAC3 (0.41) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL23675002 | 0.76 | RARB (0.40) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL29706774 | 0.76 | HDAC3 (0.41) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL6221956 | 0.75 | HDAC3 (0.40) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL3796252 | 0.72 | RARB (0.43) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL23011980 | 0.72 | MAP3K5 (0.46) | MAP3K5RARBRARGHDAC3HDAC4 | |
| SCHEMBL23011977 | 0.72 | CA9 (0.45) | MAP3K5DGAT1 | |
| SCHEMBL9379048 | 0.72 | RARB (0.43) | MAP3K5RARBRARGHDAC3HDAC4 |
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-114585616-A | Amide derivatives and their use in medicine | 广东东阳光药业有限公司 | 2022-06-03 | — | — | CN | disclosed |