Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.35 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.34 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.32 |
| ▸ | GSR | P00390 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11860261 | 0.78 | SLC6A2 (0.45) | CYP2D6CYP1A2PKMKMT2ALMNA | |
| SCHEMBL7263509 | 0.75 | FOLH1 (0.48) | GABBR2GABBR1CYP2D6CYP1A2PKM | |
| SCHEMBL148756 | 0.75 | TRPA1 (0.48) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL7683619 | 0.74 | MTNR1A (0.42) | TRPA1MTNR1AMTNR1BSLC6A2SLC6A4 | |
| SCHEMBL597894 | 0.74 | MTNR1A (0.53) | TRPA1CYP1A2MTNR1AMTNR1BSLC6A2 | |
| SCHEMBL9802284 | 0.74 | L3MBTL1 (0.51) | CYP2D6CYP1A2SMN1; SMN2KMT2AKCNH2 | |
| Boric Acid SCHEMBL21356833 | 0.73 | TRPA1 (0.43) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL3878722 | 0.71 | ALDH1A1 (0.53) | KMT2AGSRL3MBTL1 | |
| SCHEMBL28884491 | 0.71 | TRPA1 (0.50) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL11853217 | 0.69 | MEN1 (0.41) | CYP2D6CYP1A2KMT2ALMNASLC6A2 |
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-2001000631-A1 | NEW CLASSES OF HIGH LINEAR AND NONLINEAR RESPONSE COMPOUNDS | NANOWORKS, INC. (US) | 2001-01-04 | — | — | WO | disclosed |