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 | |
|---|---|---|---|---|
| SCHEMBL7395015 | 0.97 | — | — | |
| SCHEMBL9380314 | 0.95 | NOS3 (0.42) | — | |
| Iodomethane SCHEMBL9434948 | 0.91 | NOS3 (0.39) | — | |
| SCHEMBL1669865 | 0.90 | — | — | |
| SCHEMBL16385785 | 0.65 | KMT2A (0.36) | — | |
| SCHEMBL9056680 | 0.64 | — | — | |
| SCHEMBL4280209 | 0.61 | — | — | |
| Iodide SCHEMBL2889536 | 0.61 | NISCH (0.39) | — | |
| Hydrochloric Acid SCHEMBL8323256 | 0.60 | — | — | |
| SCHEMBL24971583 | 0.60 | NOS3 (0.48) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4560758-A | IMMUNOMODULATORS | PENNWALT CORPORATION (US) | 1985-12-24 | — | — | US | claimed |
| US-20090170844-A1 | Spiro Tetracyclic Compound | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | US | disclosed |
| EP-2020411-A1 | SPIRO TETRACYCLIC COMPOUND | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2009-02-04 | — | — | EP | disclosed |
| EP-0821674-B1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | SEARLE & CO (US) | 2003-08-06 | — | — | EP | disclosed |
| US-6011028-A | Cyclic amidino agents useful as nitric oxide synthase inhibitors | G.D. SEARLE & CO. (US) | 2000-01-04 | — | — | US | disclosed |
| EP-0821674-A1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 1998-02-04 | — | — | EP | disclosed |
| EP-0150255-B1 | Pyrrolo[1,2-a]imidazole and imidazo[1,2-a]pyridine immunomodulators | FISONS CORPORATION (US) | 1990-12-12 | — | — | EP | disclosed |
| US-4603206-A | ALCOHOLS, ETHERS FROM MERCAPTANS, SULFIDES;POSITIVE HALOGENATING AGENT; ALCOHOL; IMMUNOMODULATORS | PENNWALT CORPORATION (US) | 1986-07-29 | — | — | US | disclosed |
| US-4560758-A | IMMUNOMODULATORS | PENNWALT CORPORATION (US) | 1985-12-24 | — | — | US | disclosed |
| US-4551535-A | SULFIDING IN THE PRESENCE OF A BASE | PENNWALT CORPORATION (US) | 1985-11-05 | — | — | US | disclosed |
| US-4550169-A | ANTITUMOR AND ANTICARCINOGENIC AGENTS | AMERICAN CYANAMID COMPANY (US) | 1985-10-29 | — | — | US | disclosed |
| EP-0150255-A2 | Pyrrolo[1,2-a]imidazole and imidazo[1,2-a]pyridine immunomodulators | FISONS CORPORATION (US) | 1985-08-07 | — | — | EP | disclosed |
| EP-0146711-A2 | 2-hydrazino-1H-imidazoles | AMERICAN CYANAMID COMPANY (US) | 1985-07-03 | — | — | EP | disclosed |
| US-4507481-A | IMMUNOMODULATORS | PENNWALT CORPORATION (US) | 1985-03-26 | — | — | US | disclosed |