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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.78 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.76 |
| ▸ | MEN1 | O00255 | 2/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | CES1 | P23141 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 3/20 | 0.57 |
| ▸ | CA2 | P00918 | 3/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL306161 | 0.98 | POLB (0.81) | POLBKMT2AMEN1MAPK1CES1 | |
| SCHEMBL3021443 | 0.93 | POLB (0.73) | POLBKMT2AMEN1MAPK1CES1 | |
| SCHEMBL4236814 | 0.93 | POLB (0.73) | POLBKMT2AMEN1MAPK1CES1 | |
| SCHEMBL27396578 | 0.90 | POLB (0.79) | POLBKMT2AMEN1MAPK1CES1 | |
| SCHEMBL31504041 | 0.90 | POLB (0.69) | POLBKMT2AMEN1MAPK1CES1 | |
| Sulfamide SCHEMBL27805329 | 0.90 | POLB (0.79) | POLBKMT2AMEN1MAPK1CES1 | |
| 4-Nitrobenzoic Acid SCHEMBL27562391 | 0.90 | TDP1 (0.70) | POLBKMT2AMEN1MAPK1CES1 | |
| SCHEMBL12973292 | 0.88 | POLB (0.68) | POLBKMT2AMEN1MAPK1ALDH1A1 | |
| SCHEMBL14659792 | 0.88 | POLB (0.68) | POLBKMT2AMEN1MAPK1ALDH1A1 | |
| SCHEMBL7450958 | 0.88 | POLB (0.77) | POLBKMT2AMEN1MAPK1CES1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3911309-A1 | COMPOSITIONS AND METHODS FOR IMMUNE MODULATION AND TREATMENT OF CANCER | Board Of Trustees Of Michigan State University (US) | 2021-11-24 | — | — | EP | disclosed |
| WO-2020150668-A1 | COMPOSITIONS AND METHODS FOR IMMUNE MODULATION AND TREATMENT OF CANCER | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) | 2020-07-23 | — | — | WO | disclosed |