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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | PHGDH | O43175 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | CPN1 | P15169 | 1/20 | 0.37 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 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 | |
|---|---|---|---|---|
| SCHEMBL4074634 | 0.89 | F2 (0.50) | F2PHGDHMGLLHRH3KCNH2 | |
| SCHEMBL8332577 | 0.87 | F2 (0.54) | F2PHGDHMGLLHRH3KCNH2 | |
| SCHEMBL24095528 | 0.85 | MEN1 (0.40) | F2PHGDHMGLLCHRM1CPN1 | |
| Hydrochloric Acid SCHEMBL4408453 | 0.78 | F2 (0.54) | F2CHRM1 | |
| SCHEMBL7234914 | 0.77 | F2 (0.71) | F2CPN1CPB2CHIA | |
| SCHEMBL1276509 | 0.77 | — | — | |
| SCHEMBL29033745 | 0.75 | L3MBTL3 (0.47) | F2CHRM1CPN1CPB2 | |
| Hydrochloric Acid SCHEMBL6802915 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL28848374 | 0.73 | HRH3 (0.44) | PHGDHMGLLCHRM1HRH3KCNH2 | |
| SCHEMBL26986703 | 0.71 | PHGDH (0.39) | PHGDHMGLLHRH3KCNH2POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0679645-A1 | Pharmacologically active CNS pyridmidin compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-11-02 | — | — | EP | disclosed |
| EP-0459819-A2 | Pharmacologically active CNS compound | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-12-04 | — | — | EP | disclosed |