Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP4 | P49662 | 1/20 | 0.40 |
| ▸ | CASP5 | P51878 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1443055 | 0.91 | DRD2 (0.44) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL13276224 | 0.91 | BCHE (0.51) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL12812051 | 0.91 | MAPT (0.46) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL27865624 | 0.91 | HTR1A (0.47) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL1442810 | 0.91 | HTR1A (0.51) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL1443280 | 0.91 | DRD2 (0.51) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL27865644 | 0.90 | HTR1A (0.44) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL10179675 | 0.89 | HTR1A (0.52) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL10179010 | 0.89 | MKNK2 (0.46) | DRD2HTR1ANPC1RAB9AMAPT | |
| SCHEMBL13276526 | 0.89 | MAPT (0.55) | DRD2HTR1AMAPTMAPK1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102596932-A | Substituted aminoquinoxalines as tyrosine threonine kinase inhibitors | BAYER SCHERING PHARMA AG | 2012-07-18 | — | — | CN | claimed |