Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 4/20 | 0.44 |
| ▸ | THRA | P10827 | 2/20 | 0.44 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 3/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL91872 | 0.89 | THRA (0.41) | THRBTHRANR5A1RARBPLA2G2A | |
| SCHEMBL91924 | 0.86 | PTPN11 (0.41) | THRBTHRANR5A1RARBPLA2G2A | |
| SCHEMBL13863918 | 0.84 | PTPN11 (0.43) | THRBTHRANR5A1RARBPLA2G2A | |
| SCHEMBL91942 | 0.84 | RARB (0.47) | NR5A1RARBPLA2G2APTPN11TSHR | |
| SCHEMBL13618014 | 0.79 | THRB (0.43) | THRBTHRANR5A1RARBPLA2G2A | |
| SCHEMBL14195857 | 0.79 | THRB (0.46) | THRBTHRANR5A1RARBPLA2G2A | |
| SCHEMBL14492121 | 0.77 | NR5A1 (0.50) | NR5A1RARBTSHRNPC1RAB9A | |
| SCHEMBL6526887 | 0.76 | S1PR1 (0.59) | — | |
| SCHEMBL9552950 | 0.76 | CYP2D6 (0.59) | RARBNPC1RAB9A | |
| SCHEMBL91866 | 0.76 | PLA2G2A (0.42) | NR5A1RARBPLA2G2APTPN11TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |
| US-7531106-B2 | Mesogenic compounds, medium for electro-optical displays and electro-optical display | MERCK PATENT GMBH (DE) | 2009-05-12 | — | — | US | disclosed |