Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 5/20 | 0.66 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.66 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.66 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.66 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.62 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.62 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | CLK1 | P49759 | 1/20 | 0.59 |
| ▸ | SENP5 | Q96HI0 | 1/20 | 0.59 |
| ▸ | SENP2 | Q9HC62 | 1/20 | 0.59 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.59 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.57 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.57 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.57 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.57 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.57 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.57 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL29617711 | 0.84 | HDAC2 (0.60) | HDAC2HDAC1HDAC3NCOR2RAB9A | |
| SCHEMBL6919078 | 0.84 | HDAC1 (0.70) | HDAC2HDAC1HDAC3NCOR2RAB9A | |
| SCHEMBL18641949 | 0.84 | HDAC2 (0.60) | HDAC2HDAC1HDAC3NCOR2RAB9A | |
| SCHEMBL28863161 | 0.84 | HDAC1 (0.60) | HDAC2HDAC1HDAC3NCOR2OPRM1 | |
| SCHEMBL12057508 | 0.82 | HDAC2 (0.67) | HDAC2HDAC1HDAC3NCOR2RAB9A | |
| SCHEMBL13494017 | 0.82 | HDAC2 (0.63) | HDAC2HDAC1HDAC3NCOR2RAB9A | |
| SCHEMBL15246624 | 0.82 | NAMPT (0.69) | HDAC2HDAC1HDAC3NCOR2NAMPT | |
| SCHEMBL16141033 | 0.81 | CLK1 (0.56) | HDAC2HDAC1HDAC3NCOR2RAB9A | |
| SCHEMBL16142440 | 0.80 | PPARA (0.53) | HDAC2HDAC1HDAC3NCOR2CLK1 | |
| SCHEMBL30180461 | 0.80 | HDAC2 (1.00) | HDAC2HDAC1HDAC3NCOR2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023011416-A1 | MULTI-TARGET INHIBITOR TARGETING HDAC AND NAD SYNTHESIS AND USE OF MULTI-TARGET INHIBITOR | 中国海洋大学 | 2023-02-09 | — | — | WO | disclosed |