Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.38 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.32 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CDK9 | P50750 | 1/20 | 0.30 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14766634 | 0.97 | S1PR1 (0.41) | S1PR1S1PR3RARBFFAR4FFAR1 | |
| SCHEMBL14766804 | 0.94 | S1PR1 (0.40) | S1PR1S1PR3RARBFFAR4FFAR1 | |
| SCHEMBL14766662 | 0.93 | S1PR1 (0.33) | S1PR1S1PR3FFAR4FFAR1NPC1 | |
| SCHEMBL14767040 | 0.92 | S1PR1 (0.37) | S1PR1S1PR3RARB | |
| SCHEMBL14766990 | 0.91 | S1PR1 (0.37) | S1PR1S1PR3RARB | |
| SCHEMBL13586413 | 0.90 | S1PR1 (0.33) | S1PR1S1PR3FFAR4FFAR1NPC1 | |
| SCHEMBL14766480 | 0.89 | CCNT1 (0.33) | FFAR4ESR1CCNT1CDK9 | |
| SCHEMBL14766771 | 0.88 | CCNT1 (0.33) | CCNT1CDK9 | |
| SCHEMBL14766715 | 0.88 | NAAA (0.39) | S1PR1RARBFFAR4CCNT1CDK9 | |
| SCHEMBL12738754 | 0.87 | S1PR1 (0.36) | S1PR1S1PR3RARBFFAR4FFAR1 |
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 |