Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.54 |
| ▸ | PRKG1 | Q13976 | 2/20 | 0.54 |
| ▸ | MCHR1 | Q99705 | 8/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.52 |
| ▸ | HRH1 | P35367 | 5/20 | 0.52 |
| ▸ | HTR2B | P41595 | 5/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.52 |
| ▸ | ACACB | O00763 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6457598 | 1.00 | POLB (0.56) | POLBROCK2PRKG1MCHR1ADRA2A | |
| SCHEMBL6458805 | 1.00 | POLB (0.56) | POLBROCK2PRKG1MCHR1ADRA2A | |
| SCHEMBL6458800 | 1.00 | POLB (0.56) | POLBROCK2PRKG1MCHR1ADRA2A | |
| SCHEMBL6457584 | 1.00 | POLB (0.56) | POLBROCK2PRKG1MCHR1ADRA2A | |
| Hydrochloric Acid SCHEMBL6456654 | 0.99 | POLB (0.56) | POLBROCK2PRKG1MCHR1ADRA2A | |
| Hydrochloric Acid SCHEMBL6456644 | 0.99 | POLB (0.56) | POLBROCK2PRKG1MCHR1ADRA2A | |
| SCHEMBL6828396 | 0.90 | ACACB (0.55) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL6461468 | 0.90 | ACACB (0.55) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL6461475 | 0.90 | ACACB (0.55) | MCHR1ADRA2AHRH1HTR2BADRA1A | |
| SCHEMBL6463134 | 0.88 | ACACB (0.56) | POLBMCHR1ADRA2AHRH1HTR2B |
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-2004087669-A1 | NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF | TAISHO PHARMACEUTICAL CO. LTD. (JP) | 2004-10-14 | — | — | WO | disclosed |