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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BAD | Q92934 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4430194 | 0.98 | BAD (0.50) | BADALDH1A1 | |
| Bromide SCHEMBL1866676 | 0.96 | BAD (0.49) | BADALDH1A1 | |
| Hydrochloric Acid SCHEMBL11496936 | 0.96 | BAD (0.53) | BADALDH1A1 | |
| Perchlorate SCHEMBL3903408 | 0.90 | RAB9A (0.50) | BADMEN1POLBRAD52RAB9A | |
| Trifluoromethanesulfonic Acid SCHEMBL20495457 | 0.81 | GPR3 (0.39) | BAD | |
| Hydrochloric Acid SCHEMBL11302277 | 0.74 | BAD (0.57) | BADMEN1JAK2ALDH1A1POLB | |
| SCHEMBL19434734 | 0.71 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL4782479 | 0.71 | ATM (0.43) | ALDH1A1 | |
| SCHEMBL16736485 | 0.71 | RAD52 (0.54) | ALDH1A1RAD52RAB9A | |
| SCHEMBL31614554 | 0.71 | RAD52 (0.54) | ALDH1A1RAD52RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090173693-A1 | LYOTROPIC LIQUID CRYSTAL MEMBRANES BASED ON CROSS-LINKED TYPE I BICONTINUOUS CUBIC PHASES | NAVY, SECRETARY OF THE UNITED STATES OF AMERICA | 2009-07-09 | — | — | US | disclosed |