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 | 4/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | ALB | P02768 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.45 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.45 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9587077 | 0.88 | NR1I2 (0.51) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL9587073 | 0.88 | NR1I2 (0.51) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL9781586 | 0.87 | MAPT (0.50) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL9781582 | 0.87 | MAPT (0.50) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL9781625 | 0.86 | NR1I2 (0.59) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL20869565 | 0.83 | PTGS1 (0.47) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL9016665 | 0.82 | KCNH2 (0.53) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL9016668 | 0.82 | KCNH2 (0.53) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL8180829 | 0.81 | MAPT (0.47) | NR1I2ESR1DRD2ADRA2BHRH3 | |
| SCHEMBL8176517 | 0.81 | MAPT (0.47) | NR1I2ESR1DRD2ADRA2BHRH3 |
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-5010188-A | Cephem derivatives | EISAI CO., LTD. (JP) | 1991-04-23 | — | — | US | disclosed |
| US-5008260-A | Bactericides | EISAI CO., LTD. (JP) | 1991-04-16 | — | — | US | disclosed |
| US-4748171-A | Cephem compounds having at the 3-position a (1,4-methylene-1-piperidinio)methyl group or a (1-quinuclidinio)methyl group | EISAI CO., LTD. (JP) | 1988-05-31 | — | — | US | disclosed |