Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.43 |
| ▸ | PLD2 | O14939 | 3/20 | 0.42 |
| ▸ | PLD1 | Q13393 | 3/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2929286 | 0.90 | TNKS (0.39) | HSD11B1PLD2PLD1OPRM1CHRM2 | |
| SCHEMBL1761040 | 0.89 | ALDH1A1 (0.54) | HSD11B1ALDH1A1PIK3CDPIK3R1PLD2 | |
| SCHEMBL1760891 | 0.79 | TNKS (0.43) | HSD11B1ALDH1A1PLD2PLD1OPRM1 | |
| SCHEMBL2925732 | 0.78 | EIF4E (0.37) | ALDH1A1OPRM1KDM4E | |
| SCHEMBL2930816 | 0.73 | STAT3 (0.40) | OPRM1 | |
| SCHEMBL2932239 | 0.73 | LMNA (0.37) | ALDH1A1MAPK1NPSR1LMNA | |
| SCHEMBL2931358 | 0.73 | NPSR1 (0.40) | ALDH1A1MAPK1NPSR1LMNA | |
| SCHEMBL2930544 | 0.73 | GHSR (0.36) | ALDH1A1MAPK1LMNA | |
| SCHEMBL2930985 | 0.71 | ALDH1A1 (0.47) | ALDH1A1OPRM1KDM4ENPSR1LMNA | |
| SCHEMBL1761038 | 0.70 | CCNE1 (0.48) | ALDH1A1HTT |
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 |