Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7068463 | 0.98 | TSHR (0.48) | TSHRHTR2CNAAACA12CA1 | |
| Fluoride SCHEMBL9775443 | 0.96 | TSHR (0.47) | TSHRHTR2CNAAACA12CA1 | |
| SCHEMBL10033122 | 0.91 | — | — | |
| SCHEMBL12624782 | 0.82 | NAAA (0.56) | TSHRNAAACA12CA1CA2 | |
| SCHEMBL16382184 | 0.82 | NAAA (0.56) | TSHRNAAACA12CA1CA2 | |
| SCHEMBL18972967 | 0.81 | — | — | |
| SCHEMBL9680030 | 0.80 | TSHR (0.53) | TSHRHTR2CNAAACA12CA1 | |
| SCHEMBL30719589 | 0.80 | TSHR (0.53) | TSHRHTR2CNAAACA12CA1 | |
| SCHEMBL28562239 | 0.80 | TSHR (0.53) | TSHRHTR2CNAAACA12CA1 | |
| SCHEMBL27936337 | 0.80 | TSHR (0.53) | TSHRHTR2CNAAACA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011056448-A1 | VINYL ETHER COMPOUNDS AND METHODS OF THEIR PREPARATION AND USE | DOW GLOBAL TECHNOLOGIES LLC. (US) | 2011-05-12 | — | — | WO | disclosed |