Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.60 |
| ▸ | HTR1A | P08908 | 14/20 | 0.53 |
| ▸ | HTR1D | P28221 | 14/20 | 0.53 |
| ▸ | HTR1B | P28222 | 14/20 | 0.53 |
| ▸ | NCF1 | P14598 | 3/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 4/20 | 0.47 |
| ▸ | HTR2A | P28223 | 4/20 | 0.47 |
| ▸ | HTR7 | P34969 | 4/20 | 0.47 |
| ▸ | DRD3 | P35462 | 4/20 | 0.47 |
| ▸ | HTR2B | P41595 | 4/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10516997 | 0.87 | NCF1 (0.65) | CYP2C9HTR1AHTR1DHTR1BNCF1 | |
| SCHEMBL13525141 | 0.84 | CYP2C9 (0.67) | CYP2C9HTR1AHTR1DHTR1BNCF1 | |
| SCHEMBL428165 | 0.83 | NCF1 (0.69) | CYP2C9HTR1AHTR1DHTR1BNCF1 | |
| SCHEMBL1366345 | 0.81 | NCF1 (0.75) | NCF1ADRB2ADRB1 | |
| SCHEMBL4178112 | 0.80 | NCF1 (0.59) | CYP2C9HTR1AHTR1DHTR1BNCF1 | |
| SCHEMBL4176462 | 0.79 | NCF1 (0.72) | CYP2C9HTR1AHTR1DHTR1BNCF1 | |
| SCHEMBL3137750 | 0.75 | CYP2C9 (0.50) | CYP2C9HTR1AHTR1DHTR1BNCF1 | |
| SCHEMBL2881010 | 0.75 | CYP2C9 (0.50) | CYP2C9HTR1AHTR1DHTR1BNCF1 | |
| SCHEMBL13525153 | 0.75 | HTR1A (0.57) | CYP2C9HTR1AHTR1DHTR1BKCNH2 | |
| SCHEMBL429083 | 0.75 | CYP2C9 (0.50) | CYP2C9HTR1AHTR1DHTR1BNCF1 |
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-1646613-A1 | QUINOLINE AND QUINAZOLINE DERIVATIVES HAVING AFFINITY FOR 5HT1-TYPE RECEPTORS | GLAXO GROUP LIMITED (GB) | 2006-04-19 | — | — | EP | disclosed |
| WO-2005014552-A1 | QUINOLINE AND QUINAZOLINE DERIVATIVES HAVING AFFINITY FOR 5HT1-TYPE RECEPTORS | GLAXO GROUP LIMITED (GB) | 2005-02-17 | — | — | WO | disclosed |