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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 8/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | APAF1 | O14727 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
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 SCHEMBL9497223 | 1.00 | GAA (0.57) | GAASMN1; SMN2LMNAACHEMEN1 | |
| Iodide SCHEMBL11362885 | 0.82 | SMN1; SMN2 (0.67) | GAASMN1; SMN2LMNAACHEMEN1 | |
| Iodide SCHEMBL10930539 | 0.82 | SMN1; SMN2 (0.67) | GAASMN1; SMN2LMNAACHEMEN1 | |
| Iodide SCHEMBL11362882 | 0.82 | SMN1; SMN2 (0.67) | GAASMN1; SMN2LMNAACHEMEN1 | |
| Iodide SCHEMBL10930544 | 0.82 | SMN1; SMN2 (0.67) | GAASMN1; SMN2LMNAACHEMEN1 | |
| Iodide SCHEMBL9499203 | 0.80 | GAA (0.39) | GAASMN1; SMN2LMNAACHEKDM4E | |
| Iodide SCHEMBL9499199 | 0.80 | GAA (0.39) | GAASMN1; SMN2LMNAACHEKDM4E | |
| Hydrochloric Acid SCHEMBL11372211 | 0.79 | SMN1; SMN2 (0.67) | GAASMN1; SMN2LMNAACHEMEN1 | |
| Bromide SCHEMBL11364628 | 0.79 | SMN1; SMN2 (0.71) | GAASMN1; SMN2LMNAACHEMEN1 | |
| Hydrochloric Acid SCHEMBL11372214 | 0.79 | SMN1; SMN2 (0.67) | GAASMN1; SMN2LMNAACHEMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0271798-B1 | O-SUBSTITUTED TETRAHYDROPYRIDINE OXIME CHOLINERGIC AGENTS | WARNER-LAMBERT COMPANY (US) | 1993-04-07 | — | — | EP | disclosed |
| US-4786648-A | ANALGESIC | WARNER-LAMBERT COMPANY (US) | 1988-11-22 | — | — | US | disclosed |
| EP-0271798-A2 | O-Substituted tetrahydropyridine oxime cholinergic agents | WARNER-LAMBERT COMPANY (US) | 1988-06-22 | — | — | EP | disclosed |