Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.41 |
| ▸ | HTR3A | P46098 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | BRPF1 | P55201 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | FPR1 | P21462 | 1/20 | 0.31 |
| ▸ | SGK1 | O00141 | 1/20 | 0.30 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23747109 | 0.99 | CHRNA7 (0.41) | CHRNA7HTR3AKCNH2BRPF1TDP1 | |
| SCHEMBL23746997 | 0.85 | EGFR (0.43) | CHRNA7HTR3ABRPF1TDP1EGLN2 | |
| SCHEMBL23746999 | 0.84 | EGFR (0.42) | CHRNA7HTR3ABRPF1EGLN2BRAF | |
| SCHEMBL23747030 | 0.78 | FKBP1A (0.43) | CHRNA7HTR3AKCNH2 | |
| SCHEMBL23747015 | 0.74 | CCR4 (0.42) | EGLN2 | |
| SCHEMBL23747216 | 0.73 | EDNRB (0.40) | CHRNA7HTR3AKCNH2BRAF | |
| SCHEMBL23747082 | 0.70 | CCR4 (0.46) | — | |
| SCHEMBL23747149 | 0.70 | PTGS1 (0.35) | CHRNA7HTR3AKCNH2BRAF | |
| SCHEMBL23747096 | 0.70 | EDNRA (0.42) | TDP1SGK1 | |
| SCHEMBL23747152 | 0.69 | CHRNA7 (0.41) | CHRNA7HTR3AKCNH2 |
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-2021158516-A1 | IRE1α MODULATORS AND USES THEREOF | NIMBUS IASO, INC. (US) | 2021-08-12 | — | — | WO | disclosed |