Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 2/20 | 0.45 |
| ▸ | HTR1D | P28221 | 2/20 | 0.45 |
| ▸ | HTR1B | P28222 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4018203 | 0.93 | ALOX5 (0.47) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| SCHEMBL27765059 | 0.88 | CYP2C9 (0.48) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| SCHEMBL27765009 | 0.84 | ALOX5 (0.52) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| SCHEMBL13853418 | 0.84 | CYP2C9 (0.45) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| Hydrochloric Acid SCHEMBL3950851 | 0.83 | CYP2C9 (0.44) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| SCHEMBL7011655 | 0.82 | CYP2C9 (0.43) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| SCHEMBL2885321 | 0.82 | HTR1A (0.48) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| SCHEMBL2878333 | 0.81 | ITGB3 (0.48) | CYP2C9CYP2C19HTR1AHTR1DHTR1B | |
| SCHEMBL31731890 | 0.79 | CRBN (0.64) | ALOX5DDB1CRBNALDH1A1 | |
| SCHEMBL1787047 | 0.79 | ALDH1A1 (0.51) | MEN1KMT2AALOX5DDB1CRBN |
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-2074098-A2 | QUINOLINE COMPOUNDS | Wyeth (US) | 2009-07-01 | — | — | EP | disclosed |
| WO-2008049047-A2 | QUINOLINE COMPOUNDS | WYETH (US) | 2008-04-24 | — | — | WO | disclosed |