Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.49 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14400727 | 0.83 | SMN1; SMN2 (0.54) | SMN1; SMN2CYP2D6CYP2C9CYP2C19ADORA3 | |
| SCHEMBL6412460 | 0.78 | HCAR2 (0.50) | SMN1; SMN2ADORA3MEN1KMT2AMAPT | |
| SCHEMBL5904032 | 0.78 | COMT (0.54) | SMN1; SMN2ADORA3MEN1KMT2AMAPT | |
| SCHEMBL6414035 | 0.77 | SMN1; SMN2 (0.58) | SMN1; SMN2CYP2D6CYP2C9CYP2C19ADORA3 | |
| SCHEMBL1143192 | 0.77 | SMN1; SMN2 (0.58) | SMN1; SMN2CYP2D6CYP2C9CYP2C19ADORA3 | |
| SCHEMBL6412673 | 0.77 | SMN1; SMN2 (0.48) | SMN1; SMN2ADORA3MEN1KMT2AMAPT | |
| SCHEMBL6418397 | 0.76 | KDM4E (0.47) | SMN1; SMN2MEN1KMT2AMAPTKDM4E | |
| SCHEMBL6412005 | 0.74 | SMN1; SMN2 (0.58) | SMN1; SMN2CYP2D6CYP2C9CYP2C19ADORA3 | |
| SCHEMBL4005632 | 0.72 | CYP2D6 (0.68) | CYP2D6CYP2C9CYP2C19CYP2A6CYP2B6 | |
| SCHEMBL4923288 | 0.71 | SMN1; SMN2 (0.55) | SMN1; SMN2CYP2D6CYP2C9CYP2C19ADORA3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012020080-A2 | LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY II | GRAFFINITY PHARMACEUTICALS GMBH (DE) | 2012-02-16 | — | — | WO | disclosed |
| EP-1989204-A1 | PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS | Abbott Laboratories (US) | 2008-11-12 | — | — | EP | disclosed |
| WO-2007095628-A1 | PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS | ABBOTT LABORATORIES (US) | 2007-08-23 | — | — | WO | disclosed |
| EP-1667983-A2 | PYRAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | Merck & Co., Inc. (US) | 2006-06-14 | — | — | EP | disclosed |
| WO-2005030128-A2 | PYRAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | MERCK & CO., INC. (US) | 2005-04-07 | — | — | WO | disclosed |