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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7753033 | 0.91 | PNMT (0.35) | PNMTNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL4890082 | 0.79 | PNMT (0.37) | PNMTNPC1RAB9A | |
| Butane SCHEMBL7929221 | 0.74 | PNMT (0.36) | PNMTNPC1RAB9A | |
| Iodide SCHEMBL7930583 | 0.74 | PNMT (0.36) | PNMTNPC1RAB9A | |
| Iodide SCHEMBL7931462 | 0.74 | PNMT (0.36) | PNMTNPC1RAB9A | |
| SCHEMBL7928034 | 0.72 | PNMT (0.37) | PNMTNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL1116208 | 0.71 | PNMT (0.36) | PNMTNPC1RAB9A | |
| Butane SCHEMBL7928031 | 0.71 | PNMT (0.36) | PNMTNPC1RAB9A | |
| Butane SCHEMBL7921919 | 0.71 | PNMT (0.36) | PNMTNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL29695725 | 0.71 | PNMT (0.50) | PNMTNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0946610-B1 | HIGH ACTIVITY METALLOCENE POLYMERIZATION PROCESS | EXXONMOBIL CHEM PATENTS INC (US) | 2001-11-28 | — | — | EP | disclosed |
| EP-0946610-A1 | HIGH ACTIVITY METALLOCENE POLYMERIZATION PROCESS | EXXON CHEMICAL PATENTS INC. (US) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998028350-A1 | HIGH ACTIVITY METALLOCENE POLYMERIZATION PROCESS | EXXON CHEMICAL PATENTS INC. (US) | 1998-07-02 | — | — | WO | disclosed |