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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.83 |
| ▸ | MAPT | P10636 | 3/20 | 0.83 |
| ▸ | HPGD | P15428 | 1/20 | 0.83 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.70 |
| ▸ | HTT | P42858 | 2/20 | 0.70 |
| ▸ | NPC1 | O15118 | 2/20 | 0.70 |
| ▸ | RAB9A | P51151 | 2/20 | 0.70 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.69 |
| ▸ | RECQL | P46063 | 1/20 | 0.69 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.61 |
| ▸ | ICMT | O60725 | 1/20 | 0.59 |
| ▸ | ALB | P02768 | 1/20 | 0.59 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.59 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.59 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL9888 | 0.98 | ALDH1A1 (0.86) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| SCHEMBL11658250 | 0.96 | ALDH1A1 (0.83) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| Fluoride SCHEMBL27839088 | 0.96 | ALDH1A1 (0.83) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| Hydrochloric Acid SCHEMBL23062930 | 0.96 | ALDH1A1 (0.83) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| Bromide SCHEMBL28587932 | 0.96 | ALDH1A1 (0.83) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| Phenol SCHEMBL28178784 | 0.91 | MAPT (0.75) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| SCHEMBL9479666 | 0.91 | MAPT (1.00) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| SCHEMBL27874246 | 0.88 | ALDH1A1 (0.71) | ALDH1A1MAPTHPGDSMN1; SMN2HTT | |
| SCHEMBL2183716 | 0.86 | ALDH1A1 (0.76) | ALDH1A1MAPTHPGDSMN1; SMN2ICMT | |
| SCHEMBL3342586 | 0.85 | L3MBTL1 (0.80) | ALDH1A1MAPTHPGDSMN1; SMN2HTT |
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-2001017992-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-03-15 | — | — | WO | disclosed |