Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIMK1 | P53667 | 1/20 | 0.37 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.36 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1761002 | 0.88 | LIMK1 (0.46) | LIMK1LIMK2ADORA2ACCR2SOS1 | |
| SCHEMBL3041508 | 0.82 | PHGDH (0.47) | ADORA2A | |
| SCHEMBL2930872 | 0.81 | TRPV1 (0.40) | ADORA2ATRPV1 | |
| SCHEMBL2930871 | 0.81 | ADORA2A (0.49) | ADORA2ACCR2TRPV1ADORA2BADORA1 | |
| SCHEMBL2931382 | 0.80 | ADORA2A (0.41) | ADORA2ATRPV1ADORA2BADORA1 | |
| SCHEMBL2927982 | 0.80 | ADORA2B (0.47) | ADORA2AADORA2BADORA1 | |
| SCHEMBL2932713 | 0.80 | ADORA2A (0.49) | ADORA2ACCR2ADORA2BADORA1 | |
| SCHEMBL2928074 | 0.78 | ADORA2A (0.51) | ADORA2AADORA2BADORA1 | |
| SCHEMBL2923724 | 0.78 | KDM4E (0.46) | ADORA2A | |
| SCHEMBL2930106 | 0.78 | ADORA2A (0.41) | ADORA2ACCR2TRPV1ADORA2BADORA1 |
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 |