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 | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.47 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CHAT | P28329 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 SCHEMBL9497744 | 1.00 | HDAC8 (0.47) | HDAC8PABPC1APOBEC3AAPOBEC3GMAPT | |
| Iodide SCHEMBL9501338 | 0.81 | HDAC8 (0.52) | HDAC8PABPC1APOBEC3AAPOBEC3GMAPT | |
| Iodide SCHEMBL9501333 | 0.81 | HDAC8 (0.52) | HDAC8PABPC1APOBEC3AAPOBEC3GMAPT | |
| SCHEMBL5407676 | 0.75 | SMN1; SMN2 (0.49) | MEN1KMT2ASMN1; SMN2GAA | |
| SCHEMBL13351520 | 0.75 | SMN1; SMN2 (0.49) | MEN1KMT2ASMN1; SMN2GAA | |
| Iodide SCHEMBL11364255 | 0.74 | HDAC8 (0.55) | HDAC8PABPC1APOBEC3AAPOBEC3GMAPT | |
| SCHEMBL8069065 | 0.72 | HDAC8 (0.57) | HDAC8PABPC1APOBEC3AAPOBEC3GMAPT | |
| SCHEMBL8069063 | 0.72 | HDAC8 (0.57) | HDAC8PABPC1APOBEC3AAPOBEC3GMAPT | |
| SCHEMBL18608949 | 0.68 | MAOA (0.45) | HDAC8MAPTMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL13468797 | 0.68 | NPC1 (0.58) | MAPTMEN1KMT2ASMN1; SMN2GAA |
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 |