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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.44 |
| ▸ | RAB9A | P51151 | 7/20 | 0.44 |
| ▸ | APP | P05067 | 2/20 | 0.44 |
| ▸ | APAF1 | O14727 | 2/20 | 0.44 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | ITGAM | P11215 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | PKM | P14618 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | BLM | P54132 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL143575 | 0.81 | NPC1 (0.69) | NPC1RAB9AAPPAPAF1ITGB2 | |
| Iodide SCHEMBL3795772 | 0.81 | RAB9A (0.59) | NPC1RAB9AAPPAPAF1ITGB2 | |
| Iodide SCHEMBL3795774 | 0.81 | RAB9A (0.59) | NPC1RAB9AAPPAPAF1ITGB2 | |
| Iodide SCHEMBL873179 | 0.81 | RAB9A (0.59) | NPC1RAB9AAPPAPAF1ITGB2 | |
| SCHEMBL5482693 | 0.80 | MEN1 (0.69) | NPC1RAB9AAPPAPAF1ITGB2 | |
| SCHEMBL12040013 | 0.80 | MEN1 (0.69) | NPC1RAB9AAPPAPAF1ITGB2 | |
| SCHEMBL12761886 | 0.80 | MEN1 (0.69) | NPC1RAB9AAPPAPAF1ITGB2 | |
| SCHEMBL14372067 | 0.80 | MEN1 (0.58) | NPC1RAB9AAPPAPAF1ITGB2 | |
| SCHEMBL12520206 | 0.80 | MEN1 (0.58) | NPC1RAB9AAPPAPAF1ITGB2 | |
| SCHEMBL881492 | 0.80 | MEN1 (0.58) | NPC1RAB9AAPPAPAF1ITGB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2004713-B1 | LOADED LATEX OPTICAL MOLECULAR IMAGING PROBES | CARESTREAM HEALTH INC (US) | 2011-03-09 | — | — | EP | disclosed |