Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 6/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 6/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 4/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.35 |
| ▸ | ITGAV | P06756 | 2/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PTH1R | Q03431 | 2/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | CHUK | O15111 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL4906720 | 0.86 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CAOC3PTGIR | |
| SCHEMBL4795965 | 0.85 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CAOC3PTGIR | |
| SCHEMBL4795892 | 0.79 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CAOC3PTGIR | |
| SCHEMBL4776747 | 0.79 | PKM (0.43) | ADORA2AADORA2BADORA1TP53ESR1 | |
| SCHEMBL4792540 | 0.76 | ADRA2A (0.43) | ADRA2AADRA2BADRA2CAOC3PTGIR | |
| SCHEMBL4793607 | 0.76 | IKBKB (0.43) | ADRA2AADRA2BADRA2CAOC3PTGIR | |
| SCHEMBL4774170 | 0.76 | PKM (0.41) | ADORA2AADORA2BADORA1TP53 | |
| SCHEMBL4792493 | 0.75 | PTH1R (0.42) | ADRA2AADRA2BADRA2CAOC3PTGIR | |
| SCHEMBL4791770 | 0.75 | ADRA2A (0.39) | ADRA2AADRA2BADRA2CAOC3PTGIR | |
| SCHEMBL4792633 | 0.74 | PTH1R (0.44) | ADRA2AADRA2BADRA2CAOC3PTGIR |
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-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |