Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 8/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 6/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.31 |
| ▸ | CFB | P00751 | 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 | |
|---|---|---|---|---|
| SCHEMBL1179567 | 0.83 | CFB (0.39) | TAAR1ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL10014958 | 0.83 | TAAR1 (0.45) | TAAR1ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL1178520 | 0.74 | TAAR1 (0.47) | TAAR1ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL1178307 | 0.74 | CYP2A13 (0.43) | CFB | |
| SCHEMBL1178958 | 0.74 | GAA (0.46) | CFB | |
| SCHEMBL1179180 | 0.74 | CYP2A13 (0.41) | ADRA2AADRA2BADRA2CADRA1AAURKA | |
| SCHEMBL1178598 | 0.73 | HDAC3 (0.43) | AURKARPS6KB1 | |
| SCHEMBL17188805 | 0.72 | LMNA (0.55) | ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL1178947 | 0.72 | P2RX7 (0.45) | — | |
| SCHEMBL1178570 | 0.71 | GSK3B (0.44) | AURKARPS6KB1 |
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-2003099289-A2 | COMPOSITIONS AND THEIR USES FOR ALLEVIATING PAIN | ALLERGAN, INC. (US) | 2003-12-04 | — | — | WO | disclosed |