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 | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9310798 | 0.79 | NPC1 (0.44) | RAB9ANPC1GAAALDH1A1HTT | |
| SCHEMBL8394889 | 0.78 | RAD52 (0.60) | RAB9ANPC1GAAALDH1A1MEN1 | |
| Iodide SCHEMBL11166244 | 0.77 | RAB9A (0.48) | RAB9ANPC1GAAALDH1A1SMN1; SMN2 | |
| Iodide SCHEMBL11163928 | 0.76 | MAPT (0.51) | RAB9ANPC1GAAALDH1A1SMN1; SMN2 | |
| SCHEMBL11160015 | 0.76 | ALDH1A1 (0.67) | RAB9ANPC1GAAALDH1A1SMN1; SMN2 | |
| SCHEMBL11093767 | 0.75 | SMN1; SMN2 (0.68) | RAB9ANPC1GAAALDH1A1SMN1; SMN2 | |
| SCHEMBL4161674 | 0.74 | SIGMAR1 (0.52) | RAB9ANPC1GAAALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL14577388 | 0.73 | RAB9A (0.50) | RAB9ANPC1GAAALDH1A1SMN1; SMN2 | |
| SCHEMBL8392848 | 0.73 | KMT2A (0.64) | RAB9ANPC1ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL11413916 | 0.72 | SIGMAR1 (0.48) | RAB9ANPC1GAAALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4414211-A | HYPOGLYCEMIC/- | MCNEILAB, INC. (US) | 1983-11-08 | — | — | US | disclosed |