Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.59 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.59 |
| ▸ | CXCR5 | P32302 | 3/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | G6PD | P11413 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 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 | |
|---|---|---|---|---|
| SCHEMBL7913016 | 0.82 | TAAR1 (0.48) | ADRA2ATAAR1 | |
| SCHEMBL7918614 | 0.78 | TAAR1 (0.51) | ADRA2ATAAR1KDM4EALDH1A1TSHR | |
| SCHEMBL7919840 | 0.78 | TAAR1 (0.51) | ADRA2ATAAR1KDM4EALDH1A1TSHR | |
| SCHEMBL7909294 | 0.77 | TAAR1 (0.55) | ADRA2ATAAR1 | |
| SCHEMBL7924679 | 0.76 | TAAR1 (0.35) | ADRA2ATAAR1KDM4EALDH1A1CYP2D6 | |
| SCHEMBL7910877 | 0.75 | ADRA2A (0.62) | ADRA2ATAAR1ADRA2BADRA2CADRA1D | |
| SCHEMBL7918292 | 0.74 | ADRA2A (0.52) | ADRA2ATAAR1ADRA1AALDH1A1GAA | |
| SCHEMBL7925689 | 0.74 | ADRA2A (0.52) | ADRA2ATAAR1ADRA1AALDH1A1GAA | |
| SCHEMBL7921322 | 0.74 | ADRA2A (1.00) | ADRA2ATAAR1ADRA2BADRA2CADRA1D | |
| SCHEMBL20152367 | 0.74 | ADRA2A (1.00) | ADRA2ATAAR1ADRA2BADRA2CADRA1D |
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 |