Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 1/20 | 0.45 |
| ▸ | PYGL | P06737 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | KDM4B | O94953 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL28015753 | 0.89 | CHAT (0.47) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL15960053 | 0.89 | CHAT (0.47) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL5537927 | 0.82 | ALDH1A1 (0.47) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL8099815 | 0.82 | CHAT (0.45) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL5537925 | 0.82 | ALDH1A1 (0.47) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL256052 | 0.81 | CHAT (0.50) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL11044757 | 0.81 | ALDH1A1 (0.50) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL5539355 | 0.81 | ALDH1A1 (0.46) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL5539348 | 0.81 | ALDH1A1 (0.46) | CHATPYGLALDH1A1GRIK1GRIK2 | |
| SCHEMBL28734335 | 0.80 | CYP1A2 (0.34) | KCNH2TNNC1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102532162-B | 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles | OTSUKA PHARMA CO LTD | 2015-05-27 | — | — | CN | disclosed |