Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.36 |
| ▸ | MAOA | P21397 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR2B | P41595 | 2/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL27514263 | 0.68 | MAOB (0.40) | MAOBMAOAHTR2AHTR2CHTR2B | |
| SCHEMBL6919085 | 0.68 | TSHR (0.33) | TSHRMAPK1SMN1; SMN2L3MBTL1CHRM2 | |
| SCHEMBL19417838 | 0.67 | CYP1A2 (0.36) | MAOBMAOATSHRMAPK1SMN1; SMN2 | |
| SCHEMBL17146580 | 0.66 | CYP1A2 (0.38) | MAOBMAOATSHRMAPK1SMN1; SMN2 | |
| SCHEMBL1256099 | 0.66 | CHEK2 (0.39) | MAOBMAOATSHRMAPK1SMN1; SMN2 | |
| SCHEMBL27825774 | 0.64 | CHEK2 (0.38) | MAOBMAOATSHRMAPK1SMN1; SMN2 | |
| SCHEMBL29478279 | 0.64 | MAOB (0.44) | MAOBMAOAHTR2AHTR2CHTR2B | |
| SCHEMBL2642364 | 0.64 | MEN1 (0.39) | MAOBMAOAHTR2A | |
| SCHEMBL27514264 | 0.63 | MAOB (0.35) | MAOBMAOA | |
| SCHEMBL11616219 | 0.63 | CYP1A2 (0.44) | MAOBMAOATSHRMAPK1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000059501-A1 | WATER-SOLUBLE TRIOXANES AS POTENT AND SAFE ANTIMALARIAL AGENTS | JOHNS HOPKINS UNIVERSITY (US) | 2000-10-12 | — | — | WO | disclosed |