Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL2931382 | 0.92 | ADORA2A (0.41) | ADORA2AADORA2BADORA1 | |
| SCHEMBL2930106 | 0.89 | ADORA2A (0.41) | ADORA2AADORA2BADORA1CCR2KCNH2 | |
| SCHEMBL2927447 | 0.89 | ADORA2A (0.49) | ADORA2AADORA2BADORA1OPRM1OPRL1 | |
| SCHEMBL1760960 | 0.89 | ADORA2A (0.62) | ADORA2AADORA2BADORA1OPRM1OPRL1 | |
| SCHEMBL2930985 | 0.89 | ALDH1A1 (0.47) | ADORA2AADORA2BADORA1OPRM1OPRL1 | |
| SCHEMBL2932934 | 0.88 | ADORA2B (0.40) | ADORA2AADORA2BADORA1OPRM1OPRL1 | |
| SCHEMBL2930009 | 0.88 | KMT2A (0.37) | ADORA2AADORA2BADORA1MEN1KMT2A | |
| SCHEMBL2931122 | 0.88 | ADORA2A (0.55) | ADORA2AADORA2BADORA1OPRM1OPRL1 | |
| SCHEMBL2925675 | 0.86 | ADORA2A (0.47) | ADORA2AADORA2BADORA1OPRM1OPRL1 | |
| SCHEMBL2930871 | 0.85 | ADORA2A (0.49) | ADORA2AADORA2BADORA1SMN1; SMN2HTT |
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 |