Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.39 |
| ▸ | BCR | P11274 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CASP7 | P55210 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11923202 | 0.87 | ABL1 (0.43) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL8267844 | 0.80 | ABL1 (0.53) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL8268278 | 0.78 | ABL1 (0.52) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL8267373 | 0.78 | ABL1 (0.51) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL11923375 | 0.76 | KDM4E (0.48) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL8266816 | 0.75 | ABL1 (0.48) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL8267648 | 0.74 | PDE4B (0.49) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL8267367 | 0.74 | ABL1 (0.45) | ABL1BCRPDE4BLMNAHTT | |
| SCHEMBL2948308 | 0.73 | PTPN11 (0.52) | ABL1BCRLMNAPTPN11TP53 | |
| SCHEMBL2951241 | 0.73 | KDM4E (0.52) | TP53ALDH1A1HSD17B10AOC3KDM4E |
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 |