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 | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CHAT | P28329 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | TNKS | O95271 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL335864 | 0.97 | — | — | |
| SCHEMBL2342 | 0.97 | — | — | |
| Benzene SCHEMBL1225180 | 0.97 | MAOB (0.58) | MAOBLMNAALDH1A1CHATTP53 | |
| SCHEMBL28967 | 0.97 | — | — | |
| SCHEMBL671163 | 0.97 | MAOB (0.58) | MAOBLMNAALDH1A1CHATTP53 | |
| Benzene SCHEMBL1225177 | 0.97 | MAOB (0.58) | MAOBLMNAALDH1A1CHATTP53 | |
| Water SCHEMBL10386353 | 0.94 | MAOB (0.55) | MAOBLMNAALDH1A1CHATTP53 | |
| Hydrochloric Acid SCHEMBL498589 | 0.94 | MAOB (0.55) | MAOBLMNAALDH1A1CHATTP53 | |
| SCHEMBL5049484 | 0.94 | MAOB (0.55) | MAOBLMNAALDH1A1CHATTP53 | |
| SCHEMBL11292561 | 0.94 | MAOB (0.55) | MAOBLMNAALDH1A1CHATTP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-8259587-A | — | — | None | — | — | JP | disclosed |
| JP-H08259587-A | SUGAR-CONTAINING POLYOXAZOLINE MACROMONOMER | MITSUBISHI CHEM CORP | 1996-10-08 | — | — | JP | disclosed |