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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PYGM | P11217 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11158642 | 0.77 | ALDH1A1 (0.55) | ALDH1A1GAAL3MBTL1TDP1MTNR1B | |
| Iodide SCHEMBL11166212 | 0.76 | ALDH1A1 (0.51) | ALDH1A1GAAL3MBTL1TDP1MTNR1B | |
| SCHEMBL31522179 | 0.74 | ADRA2C (0.72) | ALDH1A1GAAL3MBTL1TDP1MTNR1B | |
| SCHEMBL11159292 | 0.69 | EPHX1 (0.64) | ALDH1A1GAAL3MBTL1POLBKDM4E | |
| SCHEMBL30979267 | 0.69 | ALDH1A1 (0.64) | ALDH1A1GAAL3MBTL1TDP1LMNA | |
| SCHEMBL3174031 | 0.69 | ALDH1A1 (0.64) | ALDH1A1GAAL3MBTL1TDP1LMNA | |
| SCHEMBL30358259 | 0.68 | ALDH1A1 (0.68) | ALDH1A1GAAL3MBTL1TDP1LMNA | |
| SCHEMBL2842257 | 0.68 | ALDH1A1 (0.68) | ALDH1A1GAAL3MBTL1TDP1LMNA | |
| SCHEMBL8306940 | 0.67 | ALDH1A1 (0.66) | ALDH1A1GAAL3MBTL1TDP1MAPT | |
| SCHEMBL28632181 | 0.66 | ALDH1A1 (0.60) | ALDH1A1GAAL3MBTL1TDP1LMNA |
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-0017484-A1 | 2-Imidazoline derivatives, process for the preparation thereof and the pharmaceutical composition of the same | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1980-10-15 | — | — | EP | disclosed |