Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.52 |
| ▸ | PPARA | Q07869 | 3/20 | 0.51 |
| ▸ | VNN1 | O95497 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.49 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.49 |
| ▸ | PYGL | P06737 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL15761751 | 0.84 | SMN1; SMN2 (0.60) | GAARAB9ANPC1SMN1; SMN2SHMT2 | |
| SCHEMBL29878904 | 0.84 | SMN1; SMN2 (0.60) | GAARAB9ANPC1SMN1; SMN2SHMT2 | |
| SCHEMBL14376791 | 0.84 | L3MBTL1 (0.50) | POLBALDH1A1HPGDHSD17B10CTDSP1 | |
| SCHEMBL1711030 | 0.83 | HDAC8 (0.59) | POLBALDH1A1HPGDHSD17B10CTDSP1 | |
| SCHEMBL20401097 | 0.82 | PTGFR (0.53) | POLBALDH1A1HPGDHSD17B10CTDSP1 | |
| SCHEMBL693716 | 0.81 | ALDH1A1 (0.69) | POLBALDH1A1HPGDHSD17B10CTDSP1 | |
| SCHEMBL5203429 | 0.80 | SHMT2 (0.56) | POLBALDH1A1HSD17B10L3MBTL1GAA | |
| SCHEMBL6840327 | 0.80 | ALDH1A1 (0.55) | POLBALDH1A1HPGDHSD17B10CTDSP1 | |
| SCHEMBL1663181 | 0.78 | PPARA (0.64) | POLBALDH1A1HPGDHSD17B10CTDSP1 | |
| SCHEMBL11935975 | 0.78 | SHMT2 (0.57) | POLBALDH1A1GAASMN1; SMN2SHMT2 |
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-3331864-A2 | 1,3,4-OXADIAZOLE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | Chong Kun Dang Pharmaceutical Corp. (KR) | 2018-06-13 | — | — | EP | disclosed |