Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | GABRP | O00591 | 2/20 | 0.34 |
| ▸ | GABRD | O14764 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.34 |
| ▸ | GABRE | P78334 | 2/20 | 0.34 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.34 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.34 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.34 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5821480 | 0.90 | ALDH1A1 (0.41) | PLAUALDH1A1ESR1 | |
| SCHEMBL5815499 | 0.88 | PTGS2 (0.35) | PTGS2PLAUALDH1A1ESR1 | |
| SCHEMBL5817548 | 0.86 | DHFR (0.36) | PLAUCYP1A2CYP2C19ALDH1A1ESR1 | |
| SCHEMBL5819664 | 0.82 | PTGS2 (0.39) | PTGS2PTGS1GABRPGABRDGABRA1 | |
| SCHEMBL5817617 | 0.81 | MAPK14 (0.36) | SRCKDRALDH1A1MAPK13GCGR | |
| SCHEMBL5822051 | 0.80 | KATNA1 (0.37) | PLAUCYP1A2ALDH1A1 | |
| SCHEMBL4861654 | 0.79 | PTGS2 (0.42) | PTGS2PTGS1GABRPGABRDGABRA1 | |
| SCHEMBL5821418 | 0.78 | TP53 (0.43) | PTGS2CYP2C19ALDH1A1 | |
| SCHEMBL7245244 | 0.78 | MAPK13 (0.40) | GABRA2GABRB2ALDH1A1ESR1MAPK13 | |
| SCHEMBL5817771 | 0.76 | PTGS2 (0.43) | PTGS2PTGS1GRM5ALDH1A1 |
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-2006129181-A2 | PREPARATION OF 4-PYRIMIDONE DERIVATIVES FOR TREATING INFLAMMATORY DISEASES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2006-12-07 | — | — | WO | claimed |