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 | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 5/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PGR | P06401 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | FAP | Q12884 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.37 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 3/20 | 0.37 |
| ▸ | APAF1 | O14727 | 2/20 | 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 SCHEMBL9004551 | 0.95 | MAPT (0.41) | NR1I2PPARGPGRESR1TDP1 | |
| Iodide SCHEMBL9004579 | 0.94 | NR1I2 (0.42) | NR1I2PPARGPGRESR1TDP1 | |
| Iodide SCHEMBL9004555 | 0.92 | NR1I2 (0.43) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9100835 | 0.89 | MAPT (0.44) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9100840 | 0.89 | MAPT (0.44) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9098143 | 0.89 | MAPT (0.43) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9098132 | 0.89 | MAPT (0.43) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9004598 | 0.88 | MAPT (0.43) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9004594 | 0.88 | MAPT (0.43) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9101254 | 0.87 | MAPT (0.42) | NR1I2PPARGPGRESR1TDP1 |
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-5534508-A | EFFECTIVE AGAINST METHICILLIN-RESISTANT STAPHYLOCOCCUS | KATAYAMA SEIYAKUSYO CO., LTD. (JP) | 1996-07-09 | — | — | US | disclosed |