Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 10/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20421054 | 0.90 | HDAC1 (0.46) | S1PR5S1PR1HDAC1HDAC6LMNA | |
| SCHEMBL20420947 | 0.86 | S1PR5 (0.48) | S1PR5S1PR1HDAC1HDAC6KDM4E | |
| SCHEMBL17078935 | 0.86 | HDAC6 (0.62) | HDAC1HDAC6LMNA | |
| SCHEMBL20432864 | 0.86 | HDAC6 (0.62) | HDAC1HDAC6LMNA | |
| SCHEMBL17078864 | 0.86 | LMNA (0.59) | S1PR5S1PR1HDAC1HDAC6LMNA | |
| SCHEMBL20421024 | 0.84 | S1PR5 (0.52) | S1PR5S1PR1HDAC1HDAC6S1PR4 | |
| SCHEMBL20421074 | 0.83 | HDAC1 (0.49) | S1PR5S1PR1HDAC1HDAC6LMNA | |
| SCHEMBL20420884 | 0.83 | S1PR5 (0.53) | S1PR5S1PR1HDAC1HDAC6KDM1A | |
| SCHEMBL20420931 | 0.82 | HDAC1 (0.60) | S1PR5S1PR1HDAC1HDAC6KDM4E | |
| SCHEMBL20420981 | 0.82 | HDAC1 (0.60) | S1PR5S1PR1HDAC1HDAC6KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3116859-B1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-08-01 | — | — | EP | disclosed |