Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 13/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 7/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 7/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 6/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27264625 | 0.86 | KEAP1 (0.47) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL25494154 | 0.81 | CHRM3 (0.49) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL9618869 | 0.81 | KEAP1 (0.49) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL7702614 | 0.80 | ALDH1A1 (0.47) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL28195129 | 0.80 | KEAP1 (0.47) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL4883114 | 0.79 | KEAP1 (0.50) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL21742053 | 0.79 | CHRM2 (0.38) | CHRM3CHRM2 | |
| SCHEMBL23762839 | 0.78 | CHRM3 (0.44) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL27779719 | 0.77 | KCNN4 (0.49) | KEAP1NFE2L2CHRM3CHRM2CHRM1 | |
| SCHEMBL21742345 | 0.77 | CHRM2 (0.39) | CHRM3CHRM2ALDH1A1 |
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-101636155-A | Inhibitors of diacylglycerol O-acyltransferase type 1 enzyme | ABBOTT LAB | 2010-01-27 | — | — | CN | disclosed |