Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 4/20 | 0.54 |
| ▸ | THRA | P10827 | 2/20 | 0.52 |
| ▸ | MGLL | Q99685 | 2/20 | 0.52 |
| ▸ | SNCA | P37840 | 2/20 | 0.50 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.43 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.43 |
| ▸ | TRPM2 | O94759 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11611649 | 1.00 | TSHR (0.54) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11761767 | 1.00 | TSHR (0.54) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11762130 | 1.00 | TSHR (0.54) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11762122 | 1.00 | TSHR (0.54) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11761761 | 1.00 | TSHR (0.54) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11764699 | 0.99 | THRB (0.55) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11764696 | 0.99 | THRB (0.55) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11765937 | 0.95 | SNCA (0.52) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11765941 | 0.95 | SNCA (0.52) | TSHRHSD17B10THRBTHRAMGLL | |
| SCHEMBL11767692 | 0.90 | THRB (0.52) | THRBMGLLSNCAALDH1A1RAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4061587-A | Liquid crystalline cinnamic acid esters | HOFFMANN-LA ROCHE INC. (US) | 1977-12-06 | — | — | US | claimed |
| US-4066570-A | OPTICAL CELLS, NEMATIC MIXTURES, LIQUID CRYSTALS | HOFFMAN-LA ROCHE INC. (US) | 1978-01-03 | — | — | US | disclosed |
| US-4061587-A | Liquid crystalline cinnamic acid esters | HOFFMANN-LA ROCHE INC. (US) | 1977-12-06 | — | — | US | disclosed |
| US-3997536-A | LIQUID CRYSTALS | HOFFMANN-LA ROCHE INC. (US) | 1976-12-14 | — | — | US | disclosed |