Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23926449 | 0.84 | CHRNA7 (0.35) | — | |
| Bromide SCHEMBL20604280 | 0.83 | CHRNA7 (0.34) | — | |
| SCHEMBL20604494 | 0.82 | ALDH1A1 (0.35) | CA2 | |
| SCHEMBL23926424 | 0.76 | APP (0.37) | CHRM3 | |
| Bromide SCHEMBL20604553 | 0.74 | CHRNB2 (0.36) | CHRM3 | |
| SCHEMBL23926442 | 0.72 | TRPV1 (0.33) | — | |
| SCHEMBL4906438 | 0.72 | PTK2 (0.32) | — | |
| SCHEMBL23926453 | 0.70 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL1416810 | 0.70 | CA2 (0.59) | CA2 | |
| SCHEMBL4893255 | 0.70 | PTK2 (0.31) | — |
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 |