Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.35 |
| ▸ | APLNR | P35414 | 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 | |
|---|---|---|---|---|
| SCHEMBL1126175 | 0.84 | ADRA2A (0.49) | ALDH1A1SMN1; SMN2KDM4ECYP1A2GAA | |
| SCHEMBL18399532 | 0.74 | POLB (0.46) | ALDH1A1SMN1; SMN2CYP1A2GAAMAPT | |
| SCHEMBL4209119 | 0.72 | MAPK1 (0.47) | ALDH1A1KDM4EGAAMAPTNPC1 | |
| SCHEMBL14658480 | 0.71 | TSHR (0.55) | ALDH1A1SMN1; SMN2KDM4ECYP1A2GAA | |
| SCHEMBL5380629 | 0.71 | CYP1A2 (0.47) | ALDH1A1SMN1; SMN2KDM4ECYP1A2GAA | |
| SCHEMBL20919073 | 0.71 | MAPT (0.44) | ALDH1A1SMN1; SMN2CYP1A2GAAMAPT | |
| SCHEMBL11419834 | 0.69 | HSPB1 (0.50) | ALDH1A1SMN1; SMN2KDM4EMAPTPOLB | |
| SCHEMBL8200767 | 0.68 | POLB (0.49) | ALDH1A1SMN1; SMN2KDM4ECYP1A2GAA | |
| SCHEMBL4873349 | 0.68 | MAPT (0.45) | ALDH1A1SMN1; SMN2KDM4ECYP1A2GAA | |
| SCHEMBL14399403 | 0.68 | MAPT (0.45) | ALDH1A1SMN1; SMN2KDM4ECYP1A2GAA |
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-2282995-A1 | DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS | Novartis AG (CH) | 2011-02-16 | — | — | EP | disclosed |
| WO-2009141386-A1 | DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS | NOVARTIS AG (CH) | 2009-11-26 | — | — | WO | disclosed |