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 | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.51 |
| ▸ | MAOB | P27338 | 3/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | HBB | P68871 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.45 |
| ▸ | S100A4 | P26447 | 1/20 | 0.45 |
| ▸ | SNCA | P37840 | 1/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL7734358 | 1.00 | MAOA (0.51) | MAOAMAOBRELARAB9AMAPT | |
| SCHEMBL25721233 | 0.84 | MAOA (0.50) | MAOAMAOBRELARAB9AMAPT | |
| SCHEMBL30301304 | 0.81 | NPC1 (0.54) | MAOAMAOBRAB9AMAPTNPC1 | |
| SCHEMBL11212898 | 0.81 | NPC1 (0.54) | MAOAMAOBRAB9AMAPTNPC1 | |
| SCHEMBL7079525 | 0.78 | L3MBTL1 (0.51) | MAOAMAOBRAB9AMAPTNPC1 | |
| SCHEMBL2301022 | 0.78 | DCTPP1 (0.48) | RAB9AMAPTNPC1MEN1KMT2A | |
| SCHEMBL28711796 | 0.78 | TDP1 (0.44) | MAOAMAOBRAB9AMAPTNPC1 | |
| SCHEMBL1597234 | 0.74 | RELA (0.63) | MAOAMAOBRELARAB9AMAPT | |
| SCHEMBL1597235 | 0.74 | RELA (0.63) | MAOAMAOBRELARAB9AMAPT | |
| SCHEMBL3844746 | 0.74 | RELA (0.63) | MAOBRELARAB9AMAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20020106354-A1 | CELLULAR AND ANIMAL MODELS FOR DISEASES ASSOCIATED WITH ALTERED MITOCHONDRIAL FUNCTION | MITOKOR | 2002-08-08 | — | — | US | disclosed |
| EP-1076691-A1 | CELLULAR AND ANIMAL MODELS FOR DISEASES ASSOCIATED WITH ALTERED MITOCHONDRIAL FUNCTION | Mitokor (US) | 2001-02-21 | — | — | EP | disclosed |
| WO-1999055845-A1 | CELLULAR AND ANIMAL MODELS FOR DISEASES ASSOCIATED WITH ALTERED MITOCHONDRIAL FUNCTION | MITOKOR (US) | 1999-11-04 | — | — | WO | disclosed |