Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 8/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL20604466 | 0.99 | HTR1A (0.35) | HTR1AHTR7ALDH1A1RECQLPRSS1 | |
| SCHEMBL23926426 | 0.91 | PRSS1 (0.40) | PRSS1CHRM3 | |
| Bromide SCHEMBL20604544 | 0.90 | PRSS1 (0.39) | PRSS1CHRM3 | |
| SCHEMBL23926424 | 0.82 | APP (0.37) | ALDH1A1RECQLCHRM3APP | |
| Bromide SCHEMBL20604553 | 0.81 | CHRNB2 (0.36) | ALDH1A1RECQLCHRM3APP | |
| SCHEMBL3008411 | 0.77 | ALDH1A1 (0.57) | ALDH1A1RECQLPRSS1KMT2AAPP | |
| SCHEMBL31638056 | 0.77 | ALDH1A1 (0.57) | ALDH1A1RECQLPRSS1KMT2AAPP | |
| SCHEMBL23926437 | 0.74 | HTR1A (0.34) | HTR1AHTR7KMT2ACYP2D6CHRM3 | |
| SCHEMBL23926451 | 0.74 | CYP1A2 (0.38) | CYP2D6 | |
| Bromide SCHEMBL20604460 | 0.73 | POLB (0.34) | HTR1AHTR7CYP2D6CHRM3 |
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 |