Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2073880 | 0.67 | CYP1A2 (0.32) | CYP1A2CYP2A6CA1CA2CA7 | |
| SCHEMBL2056254 | 0.60 | MAOB (0.40) | SMN1; SMN2CYP1A2CYP2A6ALDH1A1MAOA | |
| SCHEMBL8404486 | 0.60 | SMN1; SMN2 (0.53) | SMN1; SMN2CYP1A2CYP2A6ALDH1A1MCL1 | |
| SCHEMBL5542790 | 0.60 | ELANE (0.56) | ALDH1A1MAOAMAOB | |
| SCHEMBL12355735 | 0.60 | ELANE (0.35) | SMN1; SMN2CYP1A2CYP2A6CA1CA2 | |
| SCHEMBL2514183 | 0.58 | ELANE (0.32) | SMN1; SMN2CYP1A2ALDH1A1MAOA | |
| SCHEMBL1611920 | 0.58 | CYP2A6 (0.55) | SMN1; SMN2CYP1A2CYP2A6CA1CA2 | |
| SCHEMBL598761 | 0.57 | TSHR (0.53) | SMN1; SMN2CYP1A2CYP2A6CA1CA2 | |
| SCHEMBL4021982 | 0.53 | ACHE (0.57) | CYP1A2CYP2A6CA1CA2CA7 | |
| SCHEMBL40704 | 0.53 | — | — |
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-0835242-A1 | THIOAMIDES S-OXIDES FOR USE AS PESTICIDES | Novartis AG (CH) | 1998-04-15 | — | — | EP | disclosed |
| WO-1997000859-A1 | THIOAMIDES S-OXIDES FOR USE AS PESTICIDES | NOVARTIS AG (CH) | 1997-01-09 | — | — | WO | disclosed |