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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | PDE4A | P27815 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.45 |
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 SCHEMBL9306914 | 0.90 | LMNA (0.53) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| Iodide SCHEMBL9310792 | 0.90 | LMNA (0.53) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| Iodide SCHEMBL9307059 | 0.85 | NPC1 (0.61) | ALDH1A1CYP1A2SMN1; SMN2MEN1NPC1 | |
| Iodide SCHEMBL9307144 | 0.80 | LMNA (0.44) | ALDH1A1LMNASMN1; SMN2NPC1RAB9A | |
| Iodide SCHEMBL9307397 | 0.80 | PLA2G4B (0.46) | SMN1; SMN2PLA2G4B | |
| Iodide SCHEMBL9307473 | 0.80 | PLA2G4B (0.46) | SMN1; SMN2PLA2G4B | |
| Iodide SCHEMBL9307178 | 0.80 | LMNA (0.44) | ALDH1A1LMNASMN1; SMN2NPC1RAB9A | |
| Iodide SCHEMBL9305539 | 0.78 | TSHR (0.53) | KDM4ECYP1A2MEN1NPC1RAB9A | |
| Iodide SCHEMBL9307244 | 0.78 | SMN1; SMN2 (0.47) | SMN1; SMN2PLA2G4B | |
| Iodide SCHEMBL9309225 | 0.78 | SMN1; SMN2 (0.47) | SMN1; SMN2PLA2G4B |
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-5328921-A | Antagonist of platelet activating factor | AMERICAN CYANAMID COMPANY (US) | 1994-07-12 | — | — | US | disclosed |
| US-5208247-A | Antianaphylactic agents or septic shock | AMERICAN CYANAMID COMPANY (US) | 1993-05-04 | — | — | US | disclosed |
| EP-0530444-A1 | Aryl, amide, imide, and carbamate pyridine antagonists of platelet activating factor | AMERICAN CYANAMID COMPANY (US) | 1993-03-10 | — | — | EP | disclosed |