Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.43 |
| ▸ | CHRNG | P07510 | 2/20 | 0.43 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.43 |
| ▸ | CHRND | Q07001 | 2/20 | 0.43 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11782466 | 0.88 | HPGD (0.54) | ALDH1A1HPGDSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11779231 | 0.84 | SLC6A2 (0.43) | ALDH1A1HPGDSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11780806 | 0.84 | L3MBTL1 (0.48) | ALDH1A1SLC6A2SLC6A3PARP1CHRNA1 | |
| SCHEMBL11783170 | 0.81 | TSHR (0.54) | HPGDSLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL11779998 | 0.77 | TSHR (0.50) | HPGDSLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL13911266 | 0.75 | HPGD (0.73) | ALDH1A1HPGDPARP1MAPTGAA | |
| SCHEMBL5660378 | 0.75 | SLC6A2 (0.51) | ALDH1A1HPGDSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11779692 | 0.75 | HPGD (0.64) | ALDH1A1HPGDSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5432092 | 0.74 | HPGD (0.77) | ALDH1A1HPGDPARP1BLMSMN1; SMN2 | |
| SCHEMBL2599198 | 0.74 | SLC6A2 (0.50) | ALDH1A1HPGDSLC6A2SLC6A4SLC6A3 |
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-3982931-A | N,N-di-sec.butyl-benzamide herbicides | MONTEDISON S.P.A. (IT) | 1976-09-28 | — | — | US | disclosed |