Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PORCN | Q9H237 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP4 | P49662 | 1/20 | 0.41 |
| ▸ | CASP5 | P51878 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 3/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | WNT1 | P04628 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12812462 | 0.93 | HTR1A (0.47) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL1443280 | 0.93 | DRD2 (0.51) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL27865644 | 0.92 | HTR1A (0.44) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL27865624 | 0.92 | HTR1A (0.47) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL1442810 | 0.91 | HTR1A (0.51) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL10178967 | 0.91 | KCNQ2 (0.46) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL1442923 | 0.91 | DRD2 (0.44) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL12812052 | 0.91 | PSEN1 (0.51) | HTR1ADRD2RORCNPC1RAB9A | |
| SCHEMBL12812513 | 0.91 | NPC1 (0.48) | HTR1ADRD2NPC1RAB9AWNT3A | |
| SCHEMBL10179675 | 0.90 | HTR1A (0.52) | HTR1ADRD2RORCNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011026579-A1 | SUBSTITUTED AMINOQUINOXALINES AS TYROSINE THREONINE KINASE INHIBITORS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2011-03-10 | — | — | WO | disclosed |