Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | TLR4 | O00206 | 1/20 | 0.31 |
| ▸ | TLR2 | O60603 | 1/20 | 0.31 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.31 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.31 |
| ▸ | ATP4A | P20648 | 2/20 | 0.31 |
| ▸ | ATP4B | P51164 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14766211 | 0.97 | S1PR1 (0.35) | S1PR1S1PR3AHRHDAC8FFAR4 | |
| SCHEMBL14766213 | 0.95 | HMOX1 (0.35) | S1PR1S1PR3AHRHDAC8FFAR4 | |
| SCHEMBL14766531 | 0.93 | AHR (0.34) | S1PR1S1PR3AHRHDAC8FFAR4 | |
| SCHEMBL14765850 | 0.93 | HDAC8 (0.33) | S1PR1S1PR3AHRHDAC8FFAR4 | |
| SCHEMBL14765948 | 0.92 | S1PR1 (0.32) | S1PR1S1PR3AHRHDAC8 | |
| SCHEMBL14767175 | 0.90 | AHR (0.34) | S1PR1S1PR3AHRHDAC8FFAR4 | |
| SCHEMBL12734528 | 0.90 | AHR (0.35) | S1PR1S1PR3AHRHDAC8FFAR4 | |
| SCHEMBL14766156 | 0.89 | HMOX1 (0.35) | AHRFFAR4FFAR1HMOX1PTGS2 | |
| SCHEMBL12734532 | 0.89 | HDAC8 (0.36) | S1PR1S1PR3AHRHDAC8CRBN | |
| SCHEMBL12734543 | 0.88 | HDAC8 (0.36) | S1PR1S1PR3AHRHDAC8CRBN |
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 |
|---|---|---|---|---|---|---|---|
| US-8394294-B2 | Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2013-03-12 | — | — | US | disclosed |