Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | HTR4 | Q13639 | 15/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL598741 | 0.91 | BCHE (0.46) | BCHEACHEHTR4CYP1A2CYP2C9 | |
| SCHEMBL7903337 | 0.91 | CNR1 (0.42) | BCHEACHEHTR4CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL599500 | 0.90 | BCHE (0.45) | BCHEACHEHTR4CYP1A2CYP2C9 | |
| SCHEMBL7913386 | 0.86 | GAA (0.45) | HTR4LMNA | |
| SCHEMBL599048 | 0.85 | BCHE (0.44) | BCHEACHEHTR4CYP1A2CYP2C9 | |
| SCHEMBL599770 | 0.85 | BCHE (0.44) | BCHEACHEHTR4SLC6A2SLC6A3 | |
| SCHEMBL597820 | 0.83 | BCHE (0.46) | BCHEACHEHTR4CYP1A2CYP2C9 | |
| SCHEMBL598726 | 0.82 | CHRM1 (0.45) | BCHEACHEHTR4CYP1A2CYP2C9 | |
| SCHEMBL598276 | 0.81 | CNR1 (0.43) | BCHEACHEHTR4CYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL597406 | 0.80 | HTR4 (0.43) | BCHEACHEHTR4CYP1A2CYP2C9 |
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-2010065743-A2 | BICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME | NANOTHERAPEUTICS, INC. (US) | 2010-06-10 | — | — | WO | disclosed |