Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 5/20 | 0.55 |
| ▸ | CDK2 | P24941 | 5/20 | 0.54 |
| ▸ | CDK4 | P11802 | 3/20 | 0.51 |
| ▸ | CDK1 | P06493 | 3/20 | 0.51 |
| ▸ | SRC | P12931 | 2/20 | 0.51 |
| ▸ | BRAF | P15056 | 4/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.47 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.46 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.46 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735339 | 0.82 | BRAF (0.58) | IKBKBCDK2CDK4CDK1SRC | |
| SCHEMBL1570769 | 0.79 | CA2 (0.52) | IKBKBCDK2CDK4CDK1CCNA2 | |
| SCHEMBL12120858 | 0.78 | BRAF (0.53) | CDK1BRAF | |
| SCHEMBL5505032 | 0.76 | EGFR (0.53) | BRAF | |
| SCHEMBL6223985 | 0.75 | NPC1 (0.54) | IKBKBCDK2CDK4CDK1SRC | |
| SCHEMBL1348425 | 0.74 | TSHR (0.73) | IKBKBTSHRNPSR1GAASIGMAR1 | |
| SCHEMBL4060312 | 0.74 | CDK1 (0.72) | CDK2CDK4CDK1CCNB1 | |
| SCHEMBL3521886 | 0.73 | IKBKB (0.73) | IKBKBCDK2CDK4CDK1 | |
| SCHEMBL1632241 | 0.73 | SRC (0.52) | SRCSIGMAR1 | |
| SCHEMBL4061525 | 0.73 | CDK1 (0.56) | IKBKBCDK2CDK4CDK1CCNB1 |
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-2008068507-A2 | 2 -PHENYLAMINO, 6- (PYRID-3-YL) QUINAZOLINE DERIVATIVES AS RAF-PROTEIN KINASE INHIBITORS IN CANCER TREATMENT | ASTRAZENECA AB (SE) | 2008-06-12 | — | — | WO | claimed |