Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 5/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.41 |
| ▸ | CRYZ | Q08257 | 1/20 | 0.41 |
| ▸ | VAT1 | Q99536 | 1/20 | 0.41 |
| ▸ | RTN4 | Q9NQC3 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 2/20 | 0.39 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.39 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.39 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.39 |
| ▸ | CKS1B | P61024 | 2/20 | 0.39 |
| ▸ | SKP1 | P63208 | 2/20 | 0.39 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.37 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21137337 | 0.83 | CXCR2 (0.41) | KRASEGFRHMOX2CRYZVAT1 | |
| SCHEMBL21136729 | 0.83 | GPR119 (0.41) | KITCKS1BSKP1SKP2ALK | |
| SCHEMBL21136914 | 0.82 | KDM4E (0.40) | KRASEGFRHMOX2CRYZVAT1 | |
| SCHEMBL21137067 | 0.82 | KRAS (0.51) | KRASEGFRHMOX2CRYZVAT1 | |
| SCHEMBL21099225 | 0.77 | KRAS (0.68) | KRASEGFRHMOX2CRYZVAT1 | |
| SCHEMBL21137320 | 0.74 | KRAS (0.43) | KRASEGFRHMOX2CRYZVAT1 | |
| SCHEMBL16637000 | 0.72 | KRAS (0.44) | KRASEGFRHMOX2CRYZVAT1 | |
| SCHEMBL18153456 | 0.71 | KRAS (0.47) | KRASEGFRHMOX2CRYZVAT1 | |
| SCHEMBL21137556 | 0.71 | GPR119 (0.41) | KITALKGPR119BACE1 | |
| SCHEMBL18128681 | 0.70 | KRAS (0.55) | KRASEGFRHMOX2CRYZVAT1 |
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-2019110751-A1 | TETRACYCLIC COMPOUNDS AS INHIBITORS OF G12C MUTANT RAS PROTEIN, FOR USE AS ANTI-CANCER AGENTS | ASTRAZENECA AB (SE) | 2019-06-13 | — | — | WO | disclosed |