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 | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 3/20 | 0.37 |
| ▸ | CNR2 | P34972 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | GFPT1 | Q06210 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 SCHEMBL8906995 | 0.98 | HCAR2 (0.43) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| Iodide SCHEMBL8906768 | 0.94 | HCAR2 (0.46) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL9076474 | 0.92 | HCAR2 (0.48) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL9076476 | 0.92 | HCAR2 (0.48) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL29626440 | 0.86 | HCAR2 (0.55) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL31681514 | 0.86 | HCAR2 (0.55) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL29626505 | 0.83 | HCAR2 (0.57) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL4583462 | 0.80 | HCAR2 (0.48) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL11322919 | 0.80 | ALDH1A1 (0.55) | HCAR2KEAP1NFE2L2MAPTCNR1 | |
| SCHEMBL1404268 | 0.80 | CNR1 (0.49) | HCAR2KEAP1NFE2L2MAPTCNR1 |
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-5639899-A | TREATMENT OF PERIPHERAL CIRCULATORY DISTURBANCES | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 1997-06-17 | — | — | US | disclosed |
| EP-0597095-B1 | PROSTAGLANDIN E1 ANALOGUE | TAISHO PHARMACEUTICAL CO LTD (JP) | 1996-10-30 | — | — | EP | disclosed |
| EP-0597095-A1 | PROSTAGLANDIN E1 ANALOGUE | TAISHO PHARMACEUTICAL CO. LTD (JP) | 1994-05-18 | — | — | EP | disclosed |