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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL6028354 | 1.00 | — | — | |
| Iodide SCHEMBL29165544 | 0.89 | — | — | |
| SCHEMBL8434 | 0.87 | — | — | |
| SCHEMBL24845 | 0.87 | — | — | |
| SCHEMBL8585535 | 0.87 | — | — | |
| Iodide SCHEMBL28436136 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL4432819 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL1476890 | 0.75 | — | — | |
| SCHEMBL9436638 | 0.75 | — | — | |
| SCHEMBL621867 | 0.75 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4601880-A | POLYMER, FORMALDEHYDE RELEASING COMPOUND | ALZA CORPORATION (US) | 1986-07-22 | — | — | US | claimed |
| US-5489281-A | Process for controlling pathogens in container | ALZA CORPORATION (US) | 1996-02-06 | — | — | US | disclosed |
| US-5417676-A | Biocide dispensing device for use in container | ALZA CORPORATION (US) | 1995-05-23 | — | — | US | disclosed |
| US-5417675-A | Antipathogen assembly | ALZA CORPORATION (US) | 1995-05-23 | — | — | US | disclosed |
| US-5176665-A | ANTIMICROBIAL DEVICE FOR URINE DRAINAGE CONTAINER | ALZA CORPORATION (US) | 1993-01-05 | — | — | US | disclosed |
| WO-1992012692-A1 | ANTIMICROBIAL DEVICE FOR URINE DRAINAGE CONTAINER | ALZA CORPORATION (US) | 1992-08-06 | — | — | WO | disclosed |
| US-4601880-A | POLYMER, FORMALDEHYDE RELEASING COMPOUND | ALZA CORPORATION (US) | 1986-07-22 | — | — | US | disclosed |
| US-4529398-A | Method for preventing contamination of catheter and drainage receptacle | BUDDY L (HONG KONG), LTD., A CORP. OF HONG KONG | 1985-07-16 | — | — | US | disclosed |
| US-4464258-A | METHENAMINE | ALZA CORPORATION (US) | 1984-08-07 | — | — | US | disclosed |
| US-4460367-A | Device containing biocide producing paraformalde and an acid | ALZA CORPORATION (US) | 1984-07-17 | — | — | US | disclosed |
| US-4445889-A | Method for delivering an agent with biocidal activity in a body fluid receiving container | ALZA CORPORATION (US) | 1984-05-01 | — | — | US | disclosed |