Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL20604280 | 0.98 | CHRNA7 (0.34) | CHRNA7CHRNB2CHRNA4POLBL3MBTL1 | |
| SCHEMBL23926453 | 0.85 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL23926423 | 0.84 | CHRM3 (0.33) | — | |
| Bromide SCHEMBL20604348 | 0.83 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL20604537 | 0.82 | CYP2C9 (0.33) | CYP3A4POLBCYP2D6 | |
| SCHEMBL12704928 | 0.81 | POLB (0.41) | CHRNA7CHRNB2CHRNA4POLBL3MBTL1 | |
| SCHEMBL23926451 | 0.80 | CYP1A2 (0.38) | CHRNA7IDO1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL10750428 | 0.79 | POLB (0.40) | CHRNA7CHRNB2CHRNA4POLBL3MBTL1 | |
| SCHEMBL20879572 | 0.78 | ALDH1A1 (0.35) | CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL12463826 | 0.77 | ALDH1A1 (0.34) | CHRNA7CHRNB2CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3423441-B1 | IODINATED ANALOGS OF CHOLINE, METHODS OF PREPARATION THEREOF, AND USE THEREOF AS MEDICAMENTS | UNIV PALACKEHO (CZ) | 2021-10-27 | — | — | EP | claimed |