Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 6/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 6/20 | 0.42 |
| ▸ | RARB | P10826 | 3/20 | 0.41 |
| ▸ | RARG | P13631 | 3/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 2/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17276170 | 0.86 | MAP3K5 (0.43) | MAP3K5HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL29706809 | 0.83 | MAP3K5 (0.44) | MAP3K5HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL29267763 | 0.80 | SIRT6 (0.40) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL259844 | 0.76 | SMYD3 (0.43) | HDAC3ALDH1A1LMNACRBNCCNB2 | |
| SCHEMBL23590705 | 0.75 | RARB (0.57) | HDAC3HDAC4HDAC1HDAC2HDAC8 | |
| SCHEMBL29706811 | 0.75 | CRBN (0.51) | MAP3K5CRBNPKM | |
| SCHEMBL3791967 | 0.74 | RARB (0.44) | MAP3K5HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL29706774 | 0.74 | HDAC3 (0.41) | MAP3K5HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL17276293 | 0.74 | HDAC3 (0.41) | MAP3K5HDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL23011959 | 0.74 | MAP3K5 (0.47) | MAP3K5HDAC3HDAC4HDAC1HDAC2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114585616-B | Amide derivatives and their use in medicine | 广东东阳光药业股份有限公司 | 2024-01-16 | — | — | CN | disclosed |
| 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 |
| WO-2021031071-A1 | AMIDE DERIVATIVE AND USE THEREOF IN MEDICINE | 广东东阳光药业有限公司 | 2021-02-25 | — | — | WO | disclosed |