Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 14/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 6/20 | 0.42 |
| ▸ | KIT | P10721 | 2/20 | 0.42 |
| ▸ | FLT3 | P36888 | 2/20 | 0.42 |
| ▸ | KRAS | P01116 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.40 |
| ▸ | CRYZ | Q08257 | 1/20 | 0.40 |
| ▸ | VAT1 | Q99536 | 1/20 | 0.40 |
| ▸ | RTN4 | Q9NQC3 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.40 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16637088 | 0.87 | KIT (0.49) | ACHEBACE1PDGFRBPDGFRAKIT | |
| SCHEMBL18128513 | 0.86 | HRH4 (0.37) | ACHEBACE1PDGFRBPDGFRAKIT | |
| SCHEMBL21839499 | 0.85 | KRAS (0.43) | ACHEBACE1PDGFRBKITKRAS | |
| SCHEMBL16637086 | 0.83 | PDGFRB (0.36) | ACHEBACE1PDGFRBPDGFRAKIT | |
| SCHEMBL16637106 | 0.83 | KRAS (0.51) | ACHEBACE1PDGFRBKITKRAS | |
| SCHEMBL19681376 | 0.79 | KRAS (0.46) | PDGFRBPDGFRAKRASEGFRHMOX2 | |
| SCHEMBL25180032 | 0.77 | ACHE (0.45) | ACHEBACE1PDGFRBPDGFRAKIT | |
| SCHEMBL21839989 | 0.75 | PDGFRB (0.49) | ACHEBACE1PDGFRBPDGFRAKIT | |
| SCHEMBL21415570 | 0.74 | KIT (0.52) | ACHEBACE1KITKRASEGFR | |
| SCHEMBL26967250 | 0.74 | KIT (0.45) | KITKRASEGFRHMOX2CRYZ |
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 |
|---|---|---|---|---|---|---|---|
| US-9840516-B2 | Substituted quinazolines as inhibitors of KRAS G12C | ARAXES PHARMA LLC (US) | 2017-12-12 | — | — | US | disclosed |