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 | |
|---|---|---|---|---|
| SCHEMBL13778693 | 0.97 | — | — | |
| SCHEMBL9562471 | 0.94 | — | — | |
| SCHEMBL18576935 | 0.81 | — | — | |
| SCHEMBL27447956 | 0.78 | — | — | |
| SCHEMBL3669888 | 0.74 | SLC6A3 (0.36) | — | |
| SCHEMBL1795836 | 0.71 | — | — | |
| SCHEMBL9562492 | 0.70 | — | — | |
| Ammonia Solution, Strong SCHEMBL6032324 | 0.69 | — | — | |
| SCHEMBL9450417 | 0.67 | — | — | |
| SCHEMBL16191156 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4148814-A | Process for preparing monohydrocarbyltin trihalides | PENNWALT CORPORATION (US) | 1979-04-10 | — | — | US | disclosed |
| US-4129584-A | Process for preparing dimethyltin dichloride | PENNWALT CORPORATION (US) | 1978-12-12 | — | — | US | disclosed |