Known targets — ChEMBL curated mechanism
ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG
The experimentally established mechanism targets of Iodide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VEGFA | P15692 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TERT | O14746 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL22034640 | 1.00 | VEGFA (0.36) | VEGFAEGLN1L3MBTL1POLBTERT | |
| Iodide SCHEMBL22034493 | 0.94 | TERT (0.39) | VEGFAEGLN1TERTALDH1A1S1PR1 | |
| SCHEMBL22083386 | 0.81 | — | — | |
| SCHEMBL20999795 | 0.79 | ALDH1A1 (0.49) | VEGFAEGLN1L3MBTL1ALDH1A1S1PR1 | |
| SCHEMBL6629974 | 0.79 | ALDH1A1 (0.49) | VEGFAEGLN1L3MBTL1ALDH1A1S1PR1 | |
| SCHEMBL6636120 | 0.79 | S1PR1 (0.41) | VEGFAEGLN1L3MBTL1POLBTERT | |
| SCHEMBL25379496 | 0.78 | VEGFA (0.37) | VEGFAEGLN1L3MBTL1POLBTERT | |
| SCHEMBL9044441 | 0.78 | VEGFA (0.37) | VEGFAEGLN1L3MBTL1POLBTERT | |
| SCHEMBL10843295 | 0.76 | SIGMAR1 (0.38) | VEGFAEGLN1L3MBTL1POLBTERT | |
| SCHEMBL2115783 | 0.76 | S1PR1 (0.47) | L3MBTL1POLBTERTALDH1A1S1PR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3891751-A1 | QUATERNARY AMMONIUM SALTS AS INHIBITORS OF TRIMETHYLAMINE PRODUCTION | Senda Biosciences, Inc. (US) | 2021-10-13 | — | — | EP | disclosed |
| WO-2020118238-A1 | QUATERNARY AMMONIUM SALTS AS INHIBITORS OF TRIMETHYLAMINE PRODUCTION | KINTAI THERAPEUTICS, INC. (US) | 2020-06-11 | — | — | WO | disclosed |