Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.64 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.64 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.57 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.57 |
| ▸ | MMP13 | P45452 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | CFD | P00746 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.56 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | F10 | P00742 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL21969929 | 0.92 | HDAC6 (0.56) | HDAC6HDAC2HDAC8EPHX2NR1H4 | |
| SCHEMBL29332482 | 0.92 | TSHR (0.64) | HDAC6HDAC2HDAC8EPHX2NR1H4 | |
| SCHEMBL23080259 | 0.92 | HDAC6 (0.56) | HDAC6HDAC2HDAC8EPHX2NR1H4 | |
| SCHEMBL24025161 | 0.92 | HDAC2 (0.56) | HDAC6HDAC2HDAC8EPHX2NR1H4 | |
| SCHEMBL28352398 | 0.86 | RORC (0.61) | CA1CA2TSHRALDH1A1GAA | |
| SCHEMBL25602690 | 0.86 | HDAC6 (0.50) | HDAC6HDAC2HDAC8EPHX2NR1H4 | |
| SCHEMBL25602189 | 0.84 | HDAC2 (0.48) | HDAC6HDAC2HDAC8EPHX2NR1H4 | |
| SCHEMBL14899838 | 0.84 | CFD (0.66) | HDAC6HDAC2HDAC8MMP13CFD | |
| SCHEMBL11900328 | 0.84 | HDAC6 (0.87) | HDAC6HDAC2HDAC8EPHX2NR1H4 | |
| SCHEMBL185381 | 0.83 | L3MBTL1 (0.64) | HDAC6HDAC2HDAC8EPHX2NR1H4 |
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-2018056546-A1 | NOVEL COMPOUND, CORE-SHELL DYE, AND PHOTOSENSITIVE RESIN COMPOSITION AND COLOR FILTER COMPRISING SAME | 삼성에스디아이 주식회사 | 2018-03-29 | — | — | WO | disclosed |