Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | HTR1D | P28221 | 2/20 | 0.37 |
| ▸ | HTR1B | P28222 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2929411 | 0.91 | ADORA2A (0.41) | GAATSHRMAPK1ALDH1A1MAPT | |
| SCHEMBL1761051 | 0.88 | MAPK1 (0.48) | NPSR1AURKAGAATSHRPOLB | |
| SCHEMBL2931169 | 0.84 | OGA (0.38) | ADORA2AADORA1LMNA | |
| Trifluoroacetic Acid SCHEMBL1761052 | 0.84 | ACHE (0.46) | NPSR1AURKAGAATSHRPOLB | |
| SCHEMBL2930809 | 0.83 | LMNA (0.40) | GAAMAPK1ALDH1A1MAPTADORA2A | |
| SCHEMBL3049811 | 0.83 | MEN1 (0.42) | TSHRMAPK1ALDH1A1MAPTADORA2A | |
| SCHEMBL2930506 | 0.81 | GPR6 (0.38) | ALDH1A1LMNA | |
| SCHEMBL2931204 | 0.81 | GPR6 (0.47) | — | |
| SCHEMBL2927982 | 0.81 | ADORA2B (0.47) | GAAALDH1A1ADORA2AADORA1SIGMAR1 | |
| SCHEMBL2931875 | 0.81 | ALDH1A1 (0.40) | GAAALDH1A1MAPTADORA2AADORA3 |
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-2027132-B1 | THIAZOLO-PYRAMIDINE / PYRIDINE UREA DERIVATIVES AS ADENOSINE A2B RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-09-15 | — | — | EP | claimed |