Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11420392 | 0.79 | TAAR1 (0.42) | TAAR1ADRA2AADRA2BADRA2CCYP2C19 | |
| SCHEMBL4322455 | 0.79 | TAAR1 (0.42) | TAAR1ADRA2AADRA2BADRA2CCYP2C19 | |
| SCHEMBL4655199 | 0.76 | ADRA2A (0.47) | TAAR1ADRA2AADRA2BADRA2CCYP2C19 | |
| SCHEMBL28824213 | 0.76 | — | — | |
| SCHEMBL5088326 | 0.75 | TAAR1 (0.50) | TAAR1ADRA2AADRA2BADRA2CCYP2C19 | |
| SCHEMBL18491235 | 0.75 | TAAR1 (0.38) | TAAR1ADRA2AADRA2BADRA2CCYP2C19 | |
| SCHEMBL5329090 | 0.75 | TAAR1 (0.38) | TAAR1ADRA2AADRA2BADRA2CCYP2C19 | |
| SCHEMBL2742130 | 0.73 | — | — | |
| SCHEMBL286875 | 0.73 | — | — | |
| SCHEMBL4656216 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329477-B1 | Polythiophenes and devices thereof | XEROX CORP (US) | 2006-08-09 | — | — | EP | disclosed |