Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6513856 | 0.78 | GABBR2 (0.50) | MAOBNFE2L2CYP1A2CA1GABBR2 | |
| SCHEMBL8973181 | 0.78 | GABBR2 (0.50) | MAOBNFE2L2CYP1A2CA1GABBR2 | |
| SCHEMBL8404223 | 0.78 | GABBR2 (0.50) | MAOBNFE2L2CYP1A2CA1GABBR2 | |
| SCHEMBL6513848 | 0.78 | GABBR2 (0.50) | MAOBNFE2L2CYP1A2CA1GABBR2 | |
| SCHEMBL8972865 | 0.78 | GABBR2 (0.50) | MAOBNFE2L2CYP1A2CA1GABBR2 | |
| SCHEMBL23683764 | 0.78 | HTR2A (0.41) | MAOBNFE2L2CYP1A2GABBR2GABRB1 | |
| SCHEMBL8973184 | 0.78 | GABBR2 (0.50) | MAOBNFE2L2CYP1A2CA1GABBR2 | |
| SCHEMBL11397403 | 0.78 | HTR2A (0.41) | MAOBNFE2L2CYP1A2GABBR2GABRB1 | |
| SCHEMBL8972871 | 0.78 | GABBR2 (0.50) | MAOBNFE2L2CYP1A2CA1GABBR2 | |
| SCHEMBL8521687 | 0.73 | MAOB (0.50) | MAOBNFE2L2CYP1A2CA1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6680157-B1 | MIXING WITH AROMATIC COMPOUND | MASSACHUSETTS INSTITUTE OF TECHNOLOGY | 2004-01-20 | — | — | US | disclosed |
| WO-2002031598-A2 | RESIST METHODS AND MATERIALS FOR UV AND ELECTRON-BEAM LITHOGRAPHY WITH REDUCED OUTGASSING | MASSACHUSETTS INSTITUTE OF TECHNOLOGY, INC. (US) | 2002-04-18 | — | — | WO | disclosed |