Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | AR | P10275 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL19586802 | 0.86 | MAOB (0.53) | BCHELMNACYP1A2PTGS1SLC6A2 | |
| SCHEMBL10426966 | 0.81 | ACACB (0.58) | BCHELMNACYP1A2PTGS1SLC6A2 | |
| SCHEMBL5269605 | 0.81 | BCHE (0.59) | BCHEGAAMAPTL3MBTL1 | |
| SCHEMBL8286103 | 0.80 | NQO1 (0.54) | LMNACYP1A2MAPTL3MBTL1 | |
| Hydrochloric Acid SCHEMBL7913851 | 0.79 | ACACB (0.56) | BCHELMNACYP1A2PTGS1SLC6A2 | |
| SCHEMBL10053088 | 0.79 | BCHE (0.60) | BCHELMNACYP1A2PTGS1SLC6A2 | |
| SCHEMBL28572476 | 0.79 | BCHE (0.60) | BCHELMNACYP1A2PTGS1SLC6A2 | |
| SCHEMBL17571680 | 0.78 | BCHE (0.52) | BCHELMNACYP1A2PTGS1SLC6A2 | |
| SCHEMBL7766511 | 0.78 | MAOB (0.56) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL7331392 | 0.78 | LMNA (0.53) | BCHELMNACYP1A2PTGS1SLC6A2 |
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-105793234-A | Monoamine oxidase-B selective inhibitor compound, pharmaceutical composition and application thereof | 英属哥伦比亚大学 | 2016-07-20 | — | — | CN | disclosed |