Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 6/20 | 0.41 |
| ▸ | TNF | P01375 | 3/20 | 0.39 |
| ▸ | LITAF | Q99732 | 3/20 | 0.39 |
| ▸ | MAP4K1 | Q92918 | 4/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 2/20 | 0.35 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.35 |
| ▸ | STK4 | Q13043 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.34 |
| ▸ | CRYZ | Q08257 | 1/20 | 0.34 |
| ▸ | VAT1 | Q99536 | 1/20 | 0.34 |
| ▸ | RTN4 | Q9NQC3 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 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 | |
|---|---|---|---|---|
| SCHEMBL21099285 | 1.00 | KRAS (0.41) | KRASTNFLITAFMAP4K1NTRK1 | |
| SCHEMBL21050970 | 0.91 | KRAS (0.43) | KRASMAP4K1NTRK1MAP4K2STK4 | |
| SCHEMBL21050961 | 0.91 | KRAS (0.43) | KRASMAP4K1NTRK1MAP4K2STK4 | |
| SCHEMBL21099404 | 0.90 | KRAS (0.41) | KRASTNFLITAFBTKCCNT1 | |
| SCHEMBL21099600 | 0.84 | KCNH2 (0.37) | BTKMETGPR119 | |
| SCHEMBL21136780 | 0.84 | KCNH2 (0.37) | BTKMETGPR119 | |
| SCHEMBL21050845 | 0.82 | KRAS (0.45) | KRASMAP4K1NTRK1EGFRHMOX2 | |
| SCHEMBL21099295 | 0.81 | KRAS (0.37) | KRASTNFLITAFMAP4K1NTRK1 | |
| SCHEMBL21099583 | 0.81 | KRAS (0.63) | KRASTNFLITAFALK | |
| SCHEMBL21137320 | 0.80 | KRAS (0.43) | KRASTNFLITAFMAP4K1EGFR |
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 |