Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL14690157 | 0.86 | NFE2L2 (0.54) | CHATTRPA1NFE2L2 | |
| SCHEMBL14690153 | 0.86 | NFE2L2 (0.54) | CHATTRPA1NFE2L2 | |
| SCHEMBL14690155 | 0.86 | NFE2L2 (0.54) | CHATTRPA1NFE2L2 | |
| Benzene SCHEMBL28841289 | 0.80 | CHAT (0.68) | CHATPTGS1PTGS2 | |
| SCHEMBL6051064 | 0.80 | CHAT (0.68) | CHATPTGS1PTGS2 | |
| SCHEMBL29794070 | 0.80 | CHAT (0.68) | CHATPTGS1PTGS2 | |
| SCHEMBL1782982 | 0.80 | CHAT (0.68) | CHATPTGS1PTGS2 | |
| SCHEMBL2774767 | 0.80 | CHAT (0.68) | CHATPTGS1PTGS2 | |
| Benzene SCHEMBL7716364 | 0.80 | CYP1A2 (0.56) | CHATPOLBL3MBTL1 | |
| Benzene SCHEMBL11235066 | 0.80 | CYP1A2 (0.56) | CHATPOLBL3MBTL1 |
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-4793977-A | MATRIX OF BONDED IONOMER, IONIC INDICATOR DYE AND BASE; INTERNAL COMBUSTION ENGINES; TESTING ACID BUILD-UP | CAPE COD RESEARCH, INC. (US) | 1988-12-27 | — | — | US | disclosed |