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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA1 known ✓ | P02708 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | TYMP | P19971 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9427990 | 0.98 | ALDH1A1 (0.35) | ALDH1A1CHIACHRNA1CHRNB2CHRNA3 | |
| Acetic Acid SCHEMBL9519438 | 0.86 | CHIA (0.39) | ALDH1A1CHIA | |
| SCHEMBL20526056 | 0.80 | CYP2D6 (0.41) | ALDH1A1 | |
| SCHEMBL20457697 | 0.75 | — | — | |
| SCHEMBL10144705 | 0.75 | — | — | |
| SCHEMBL10076591 | 0.72 | MEN1 (0.39) | CHRNA1CHRNB2CHRNA3CHRNA7CHRNA4 | |
| SCHEMBL22106056 | 0.71 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL22106055 | 0.71 | ALDH1A1 (0.36) | ALDH1A1 | |
| Bromide SCHEMBL4399728 | 0.71 | TYMP (0.38) | CHRNA1CHRNB2CHRNA3CHRNA7CHRNA4 | |
| SCHEMBL11121197 | 0.68 | ALDH1A1 (0.43) | ALDH1A1 |
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-5302620-A | Bisguanidines and fungicides containing them | BASF AKTIENGESELLSCHAFT (DE) | 1994-04-12 | — | — | US | disclosed |
| EP-0472093-B1 | Bis guanidines and fungicides containing same | BASF AG (DE) | 1993-11-03 | — | — | EP | disclosed |
| US-5242948-A | BISGUANIDINES AND FUNGICIDES CONTAINING THEM | BASF AKTIENGESELLSCHAFT (DE) | 1993-09-07 | — | — | US | disclosed |
| EP-0472093-A1 | Bis guanidines and fungicides containing same | BASF Aktiengesellschaft (DE) | 1992-02-26 | — | — | EP | disclosed |