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 | |
|---|---|---|---|---|
| SCHEMBL931359 | 0.98 | GRIN2D (0.30) | — | |
| SCHEMBL16908465 | 0.75 | — | — | |
| SCHEMBL11676267 | 0.74 | GRIN2D (0.36) | — | |
| SCHEMBL7462026 | 0.72 | KMT2A (0.33) | — | |
| SCHEMBL15922502 | 0.72 | LMNA (0.37) | — | |
| Ammonia Solution, Strong SCHEMBL28147128 | 0.72 | GRIN2D (0.34) | — | |
| SCHEMBL2056515 | 0.72 | — | — | |
| SCHEMBL23956811 | 0.71 | GRIN2D (0.32) | — | |
| Phosphine SCHEMBL4096380 | 0.71 | EPHX2 (0.30) | — | |
| SCHEMBL7452744 | 0.71 | KMT2A (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090036713-A1 | PROCESS FOR THE HYDROGENATION OF IMINES | EVONIK DEGUSSA GMBH (DE) | 2009-02-05 | — | — | US | claimed |
| EP-1991520-A1 | PROCESS FOR THE HYDROGENATION OF IMINES | Evonik Degussa GmbH (DE) | 2008-11-19 | — | — | EP | claimed |
| WO-2007101769-A1 | PROCESS FOR THE HYDROGENATION OF IMINES | EVONIK DEGUSSA GMBH (DE) | 2007-09-13 | — | — | WO | claimed |
| US-20070213540-A1 | Process for the hydrogenation of imines | DEGUSSA AG (DE) | 2007-09-13 | — | — | US | claimed |