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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 4/20 | 0.41 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.41 |
| ▸ | NNMT | P40261 | 2/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 SCHEMBL11267640 | 0.72 | NPC1 (0.59) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| Iodide SCHEMBL11257085 | 0.71 | NNMT (0.48) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| Iodide SCHEMBL11261777 | 0.69 | NPC1 (0.40) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| SCHEMBL4384975 | 0.68 | NNMT (0.50) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| SCHEMBL11545665 | 0.68 | CA2 (0.45) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| SCHEMBL13381663 | 0.68 | NNMT (0.55) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| Terephthalamide SCHEMBL27486747 | 0.68 | PARP1 (0.94) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| Terephthalamide SCHEMBL27828697 | 0.67 | PARP1 (0.82) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| Water SCHEMBL11262505 | 0.67 | NNMT (0.48) | L3MBTL1POLBCYP3A4PARP1MAPT | |
| Hydrochloric Acid SCHEMBL11270858 | 0.67 | NNMT (0.48) | L3MBTL1POLBCYP3A4PARP1MAPT |
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-4361571-A | 3-Carbamoyl-6-aminopyridinium and analogues, and their use in treating skin disorders | SCOTT EUGENE J VAN | 1982-11-30 | — | — | US | disclosed |