Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 1/20 | 0.31 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.31 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21136797 | 0.84 | CCNE2 (0.32) | CCNE2CCNE1CDK2 | |
| SCHEMBL21136786 | 0.84 | CCNE2 (0.32) | CCNE2CCNE1CDK2 | |
| SCHEMBL21136881 | 0.84 | CCNE2 (0.33) | CCNE2CCNE1CDK2 | |
| SCHEMBL21136709 | 0.82 | KRAS (0.50) | ACKR3 | |
| SCHEMBL29998951 | 0.75 | PIK3CD (0.33) | ACKR3 | |
| SCHEMBL21099999 | 0.68 | KRAS (0.51) | — | |
| SCHEMBL21136846 | 0.68 | KRAS (0.51) | — | |
| SCHEMBL21099582 | 0.68 | KRAS (0.51) | — | |
| SCHEMBL21099209 | 0.68 | KRAS (0.40) | — | |
| SCHEMBL499463 | 0.68 | NOS3 (0.41) | ACKR3 |
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 |