Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 7/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL7924845 | 0.88 | CYP1A2 (0.42) | CYP1A2CYP2C19NPSR1MAPTBACE1 | |
| SCHEMBL7920108 | 0.84 | BACE1 (0.45) | CYP1A2CYP2C19NPSR1BACE1KCNH2 | |
| SCHEMBL7913188 | 0.76 | BACE1 (0.39) | BACE1KCNH2 | |
| SCHEMBL7921968 | 0.76 | MEN1 (0.42) | BACE1KCNH2 | |
| SCHEMBL7918038 | 0.73 | BACE1 (0.43) | BACE1KCNH2ADRA2A | |
| SCHEMBL7911125 | 0.73 | TSHR (0.33) | NPSR1MAPTGAALMNABACE1 | |
| SCHEMBL2245426 | 0.72 | CYP1A2 (0.69) | CYP1A2CYP2C19NPSR1MAPTSMN1; SMN2 | |
| SCHEMBL7918070 | 0.71 | BACE1 (0.40) | BACE1KCNH2ADRA2A | |
| SCHEMBL7932277 | 0.71 | BACE1 (0.47) | BACE1KCNH2ADRA2AHTR2B | |
| SCHEMBL2245406 | 0.70 | CYP1A2 (0.65) | CYP1A2CYP2C19NPSR1MAPTSMN1; 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-2010042475-A1 | SPIROAMINOOXAZOLINE ANALOGUES AS ALPHA2C ADRENERGIC RECEPTOR MODULATORS | SCHERING CORPORATION (US) | 2010-04-15 | — | — | WO | disclosed |