Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 10/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 10/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 8/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 7/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 7/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.42 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.42 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL11245316 | 0.98 | KEAP1 (0.47) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL27838356 | 0.98 | KEAP1 (0.50) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL9858885 | 0.93 | KEAP1 (0.46) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL18788591 | 0.89 | CYP2D6 (0.41) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL10907499 | 0.89 | CYP2D6 (0.41) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL1403926 | 0.84 | KEAP1 (0.50) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL3958141 | 0.82 | KEAP1 (0.42) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL10448783 | 0.82 | KEAP1 (0.42) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL5172183 | 0.82 | KEAP1 (0.42) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL2464761 | 0.79 | CYP2D6 (0.36) | KEAP1NFE2L2CHRM2CHRM1CHRM3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1678132-A1 | PROCESS FOR THE PRODUCTION OF LACTAMS | Davy Process Technology Limited (GB) | 2006-07-12 | — | — | EP | claimed |
| WO-2005051907-A1 | PROCESS FOR THE PRODUCTION OF LACTAMS | DAVY PROCESS TECHNOLOGY LIMITED (GB) | 2005-06-09 | — | — | WO | claimed |