Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | CFB | P00751 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 10/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 8/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 7/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3670065 | 0.86 | TAAR1 (0.38) | TAAR1CFBADRA2AADRA2BADRA2C | |
| SCHEMBL3667158 | 0.85 | TAAR1 (0.40) | TAAR1CFBADRA2AADRA2BADRA2C | |
| SCHEMBL3433522 | 0.83 | CFB (0.41) | TAAR1CFBADRA2AADRA1ASLC6A2 | |
| SCHEMBL3411857 | 0.79 | CFB (0.36) | TAAR1CFBADRA2AADRA2BADRA2C | |
| SCHEMBL3415435 | 0.76 | LMNA (0.48) | TAAR1CYP2D6CYP3A4LMNABLM | |
| SCHEMBL3414027 | 0.75 | CFB (0.39) | TAAR1CFBADRA2AADRA2BADRA2C | |
| SCHEMBL3415726 | 0.75 | TAAR1 (0.40) | TAAR1CFBADRA2AADRA2BADRA2C | |
| SCHEMBL3415102 | 0.74 | CFB (0.34) | TAAR1CFBADRA2AADRA2BADRA2C | |
| SCHEMBL3666286 | 0.73 | SLC6A3 (0.43) | ADRA2AADRA2BADRA2CCYP2C19CYP3A4 | |
| SCHEMBL3415420 | 0.73 | ADRA2A (0.41) | TAAR1CFBADRA2AADRA1ASLC6A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2265269-A1 | SELECTIVE SUBTYPE ALPHA 2 ADRENERGIC AGENTS AND METHODS FOR USE THEREOF | Allergan, Inc. (US) | 2010-12-29 | — | — | EP | disclosed |
| WO-2009120648-A1 | SELECTIVE SUBTYPE ALPHA 2 ADRENERGIC AGENTS AND METHODS FOR USE THEREOF | ALLERGAN, INC. (US) | 2009-10-01 | — | — | WO | disclosed |