Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | WDR5 | P61964 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 5/20 | 0.35 |
| ▸ | CASP7 | P55210 | 5/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.35 |
| ▸ | USP2 | O75604 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.35 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11923285 | 0.85 | CYP1A2 (0.44) | WDR5CASP1CASP7CYP1A2USP2 | |
| SCHEMBL11923223 | 0.84 | PTPN11 (0.43) | AOC3PTPN11ABL1BCRWDR5 | |
| SCHEMBL11923270 | 0.83 | WDR5 (0.43) | WDR5CASP1CASP7CYP1A2USP2 | |
| SCHEMBL11923217 | 0.80 | PIK3CA (0.40) | AOC3PTPN11ABL1BCRCASP1 | |
| SCHEMBL8267659 | 0.80 | WDR5 (0.44) | AOC3PTPN11ABL1BCRWDR5 | |
| SCHEMBL11923212 | 0.79 | PIK3CA (0.38) | AOC3PTPN11ABL1BCRWDR5 | |
| SCHEMBL11923275 | 0.78 | TACR1 (0.40) | AOC3PTPN11ABL1BCRWDR5 | |
| SCHEMBL8266903 | 0.78 | OGA (0.38) | AOC3PTPN11ABL1BCRWDR5 | |
| SCHEMBL8268304 | 0.78 | ALDH1A1 (0.42) | PTPN11ABL1BCRWDR5CASP1 | |
| SCHEMBL11923282 | 0.77 | LMNA (0.38) | ABL1BCRWDR5ALDH1A1LMNA |
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-2006050476-A2 | PYRIMIDINE DERIVATIVES AS ION CHANNEL MODULATORS AND METHODS OF USE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-05-11 | — | — | WO | disclosed |