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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 6/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 5/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NPY1R | P25929 | 1/20 | 0.32 |
| ▸ | NPY2R | P49146 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9414693 | 0.99 | SMN1; SMN2 (0.36) | SMN1; SMN2KCNH2PDE3APDE3BMAPT | |
| SCHEMBL8718071 | 0.89 | SMN1; SMN2 (0.36) | SMN1; SMN2KCNH2PDE3APDE3BMAPT | |
| SCHEMBL8714966 | 0.75 | MTNR1A (0.33) | SMN1; SMN2KCNH2PDE3APDE3BMAPT | |
| SCHEMBL9414973 | 0.71 | SMN1; SMN2 (0.36) | SMN1; SMN2KCNH2PDE3APDE3BMAPT | |
| SCHEMBL8715076 | 0.70 | BRD4 (0.34) | SMN1; SMN2PDE3APDE3BMAPTLMNA | |
| Iodide SCHEMBL8309028 | 0.69 | MAPT (0.39) | SMN1; SMN2PDE3APDE3BMAPTPDE4B | |
| SCHEMBL8717945 | 0.69 | PDE4B (0.33) | SMN1; SMN2PDE3APDE3BMAPTLMNA | |
| SCHEMBL9414692 | 0.68 | SMN1; SMN2 (0.36) | SMN1; SMN2KCNH2PDE3APDE3BMAPT | |
| SCHEMBL9414771 | 0.68 | MAPT (0.40) | SMN1; SMN2PDE3APDE3BMAPTPDE4B | |
| SCHEMBL31564350 | 0.67 | DRD2 (0.42) | MAPT |
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-5739132-A | ENDOTHOXIN SHOCK; NEPHRITIS | TANABE SEIYAKU CO., LTD. (JP) | 1998-04-14 | — | — | US | disclosed |