Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 18/20 | 0.58 |
| ▸ | HRH1 | P35367 | 17/20 | 0.58 |
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.58 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.58 |
| ▸ | HTR2C | P28335 | 2/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3716823 | 0.90 | KCNH2 (0.57) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| SCHEMBL3714703 | 0.90 | KCNH2 (0.56) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| SCHEMBL3712397 | 0.90 | HRH1 (0.57) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| SCHEMBL3708676 | 0.89 | HRH3 (0.67) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| SCHEMBL3715465 | 0.88 | HRH1 (0.67) | KCNH2HRH1HTR2CCYP3A4CYP2D6 | |
| SCHEMBL3708250 | 0.87 | KCNH2 (0.53) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| SCHEMBL3714207 | 0.85 | HRH3 (0.64) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| SCHEMBL3718757 | 0.85 | HRH3 (0.64) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| Formic Acid SCHEMBL3714102 | 0.84 | HRH3 (0.61) | KCNH2HRH1HRH3ADRA1AADRA1B | |
| SCHEMBL3713716 | 0.84 | HRH3 (0.54) | KCNH2HRH1HRH3ADRA1AADRA1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010094643-A1 | QUINOLINE DERIVATIVES AND THEIR USES FOR RHINITIS AND URTICARIA | GLAXO GROUP LIMITED (GB) | 2010-08-26 | — | — | WO | claimed |
| WO-2010094643-A1 | QUINOLINE DERIVATIVES AND THEIR USES FOR RHINITIS AND URTICARIA | GLAXO GROUP LIMITED (GB) | 2010-08-26 | — | — | WO | disclosed |