Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 8/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.62 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | STK17B | O94768 | 1/20 | 0.35 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24780896 | 0.89 | HDAC3 (0.66) | HDAC3HDAC1HDAC6ACKR3HPGDS | |
| SCHEMBL23164198 | 0.86 | HDAC1 (0.65) | HDAC3HDAC1HDAC6ACKR3HPGDS | |
| SCHEMBL24780895 | 0.82 | HDAC3 (0.65) | HDAC3HDAC1HDAC6ACKR3HPGDS | |
| SCHEMBL23164203 | 0.79 | HDAC3 (0.58) | HDAC3HDAC1HDAC6ACKR3HPGDS | |
| SCHEMBL30110696 | 0.79 | HDAC3 (0.54) | HDAC3HDAC1HDAC6ACKR3HPGDS | |
| SCHEMBL24781178 | 0.78 | HDAC3 (0.64) | HDAC3HDAC1HDAC6ACKR3HPGDS | |
| SCHEMBL15580221 | 0.76 | HDAC3 (1.00) | HDAC3HDAC1HDAC6 | |
| SCHEMBL15580303 | 0.76 | HDAC3 (1.00) | HDAC3HDAC1HDAC6 | |
| SCHEMBL15580274 | 0.76 | HDAC3 (1.00) | HDAC3HDAC1HDAC6 | |
| SCHEMBL28780520 | 0.75 | HDAC3 (0.59) | HDAC3HDAC1HDAC6ACKR3HPGDS |
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-114599662-A | Neomycin-based compounds and pharmaceutical uses thereof | 蔚蓝海岸大学 | 2022-06-07 | — | — | CN | disclosed |