Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22535 | 0.80 | TSHR (0.36) | ALDH1A1NPC1TSHRLMNACA12 | |
| SCHEMBL28324682 | 0.74 | TSHR (0.34) | TSHRLMNAKMT2A | |
| SCHEMBL5695118 | 0.73 | TSHR (0.35) | ALDH1A1TSHRLMNAKMT2A | |
| Acetic Acid SCHEMBL933909 | 0.72 | TSHR (0.35) | ALDH1A1TSHRLMNACA12CA1 | |
| SCHEMBL28038042 | 0.72 | ALDH1A1 (0.38) | ALDH1A1NPC1TSHRLMNACA12 | |
| Ethyl Acetate SCHEMBL9842714 | 0.72 | ALDH1A1 (0.42) | ALDH1A1NPC1TSHRLMNACA12 | |
| Methylpyrrolidone SCHEMBL28194480 | 0.71 | BRD4 (0.61) | ALDH1A1NPC1TSHRLMNACA12 | |
| Acrylic Acid Ethyl Ester SCHEMBL251480 | 0.71 | ALDH1A1 (0.37) | ALDH1A1NPC1TSHRLMNACA12 | |
| SCHEMBL6881621 | 0.71 | TSHR (0.32) | TSHRLMNAKMT2A | |
| Urethane SCHEMBL3180161 | 0.71 | ALOX15 (0.44) | ALDH1A1NPC1TSHRLMNACA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6166236-A | Vinyl carbonate and vinyl carbamate contact lens material monomers | BAUSCH & LOMB INCORPORATED (US) | 2000-12-26 | — | — | US | claimed |
| EP-0396364-B1 | Copolymers of vinyl carbonate and vinyl carbamate as contact lens material | BAUSCH & LOMB (US) | 1997-06-11 | — | — | EP | claimed |
| EP-0396364-A2 | Novel vinyl carbonate and vinyl carbamate contact lens material monomers | BAUSCH & LOMB INCORPORATED (US) | 1990-11-07 | — | — | EP | claimed |