Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.36 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 2/20 | 0.36 |
| ▸ | ITK | Q08881 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.33 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | HPGDS | O60760 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27024729 | 0.90 | SRC (0.44) | IRAK4MAP3K7SRCADORA2AHPGD | |
| SCHEMBL27012810 | 0.89 | AKR1C1 (0.41) | IRAK4MAP3K7SRCITKADORA2A | |
| SCHEMBL27012691 | 0.89 | GRIN2B (0.36) | IRAK4MAP3K7SRCITKSMN1; SMN2 | |
| SCHEMBL24326126 | 0.88 | IRAK4 (0.34) | IRAK4MAP3K7SRCITKADORA2A | |
| SCHEMBL27012773 | 0.87 | ATR (0.41) | IRAK4MAP3K7SRCITKNTRK1 | |
| SCHEMBL27012787 | 0.85 | SRC (0.41) | SRCHPGDNTRK1 | |
| SCHEMBL24326644 | 0.85 | PARP1 (0.38) | IRAK4MAP3K7SRCMEN1KMT2A | |
| SCHEMBL27012781 | 0.84 | IRAK4 (0.35) | IRAK4MAP3K7SRCITKADORA2A | |
| SCHEMBL24325741 | 0.83 | ACACB (0.40) | SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL27024732 | 0.83 | MAP3K7 (0.34) | IRAK4MAP3K7SRCITKSMN1; SMN2 |
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-2022076625-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |