Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | AGXT | P21549 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.37 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.34 |
| ▸ | PLOD3 | O60568 | 1/20 | 0.34 |
| ▸ | PLOD1 | Q02809 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12959306 | 0.88 | KMO (0.40) | AGXTKDM4EMAPTMAPK1HTT | |
| SCHEMBL11961065 | 0.84 | MAPT (0.41) | ADRA2CHTR3AGAAKDM4EMAPT | |
| SCHEMBL12300472 | 0.83 | USP2 (0.31) | MAPK1ALDH1A1CYP1A2 | |
| SCHEMBL12314382 | 0.81 | NOS3 (0.34) | ADRA2CHTR3AGAAKDM4EMAPT | |
| SCHEMBL2940900 | 0.81 | ADRA2C (0.51) | ADRA2CAGXTHTR3AGAAKDM4E | |
| SCHEMBL31298214 | 0.81 | ADRA2C (0.51) | ADRA2CAGXTHTR3AGAAKDM4E | |
| SCHEMBL13100353 | 0.78 | HRH4 (0.43) | HTR3AKDM4EMAPK1ALDH1A1CYP1A2 | |
| SCHEMBL12970503 | 0.76 | CYP3A4 (0.33) | RECQLALDH1A1 | |
| SCHEMBL13348447 | 0.74 | NOTUM (0.41) | MAPTMEN1KMT2AALDH1A1RAB9A | |
| SCHEMBL10084317 | 0.73 | ALDH1A1 (0.33) | ALDH1A1CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2155201-B1 | QUINOXALINE DERIVATIVES AS INHIBITORS OF THE TYROSINE KINASE ACTIVITY OF JANUS KINASES | NOVARTIS AG (CH) | 2012-08-01 | — | — | EP | disclosed |