Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | PYCR1 | P32322 | 14/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26267232 | 0.82 | HDAC1 (0.59) | HDAC8HDAC1HDAC6PYCR1MAOB | |
| SCHEMBL2324617 | 0.80 | CYP2A6 (0.52) | HDAC8HDAC1HDAC6TSHRALDH1A1 | |
| SCHEMBL578205 | 0.77 | HRH3 (0.56) | HDAC8PYCR1MAOBLMNAUSP2 | |
| SCHEMBL8252038 | 0.74 | HDAC1 (0.52) | HDAC8HDAC1HDAC6PYCR1LMNA | |
| SCHEMBL819942 | 0.74 | HDAC1 (0.52) | HDAC8HDAC1HDAC6PYCR1 | |
| SCHEMBL578620 | 0.73 | HRH3 (0.59) | HDAC8HDAC6PYCR1 | |
| SCHEMBL28715270 | 0.73 | BCHE (0.42) | PYCR1CYP2C9MAOBTSHRMAOA | |
| SCHEMBL3146362 | 0.72 | HDAC1 (0.50) | HDAC8HDAC1HDAC6PYCR1MAOB | |
| SCHEMBL2483550 | 0.72 | HDAC1 (0.55) | HDAC8HDAC1HDAC6LMNAALDH1A1 | |
| SCHEMBL1639815 | 0.72 | HDAC1 (0.55) | HDAC8HDAC1HDAC6PYCR1MAOB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7563387-B2 | Comprising water-soluble salt of synthetic helical polymer having no asymmetric carbon atom as main component of main chain thereof, for example, a polyacetylene derivative having such constitution; provides an unprecedented liquid crystal material or electronic or optically functional polymer material | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2009-07-21 | — | — | US | disclosed |
| US-20070145329-A1 | Hydrophilic stiff main chain type liquid crystalline composition and chiral sensor utilizing the same | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2007-06-28 | — | — | US | disclosed |
| EP-1734075-A1 | HYDROPHILIC STIFF MAIN CHAIN TYPE LIQUID CRYSTALLINE COMPOSITION AND CHIRAL SENSOR UTILIZING THE SAME | Japan Science and Technology Agency (JP) | 2006-12-20 | — | — | EP | disclosed |