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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 17/20 | 0.35 |
| ▸ | F2 | P00734 | 16/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.34 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
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 SCHEMBL7359743 | 0.94 | F10 (0.36) | NQO2F10F2ITGB3ITGA2B | |
| Iodide SCHEMBL7354931 | 0.91 | NQO2 (0.31) | NQO2F10F2TMPRSS15 | |
| Hydrochloric Acid SCHEMBL7357014 | 0.90 | NQO2 (0.48) | NQO2F10F2ITGB3ITGA2B | |
| Iodide SCHEMBL7352288 | 0.89 | TMPRSS15 (0.39) | F10F2TMPRSS15 | |
| Iodide SCHEMBL7351241 | 0.87 | NQO2 (0.44) | NQO2F10F2ITGB3ITGA2B | |
| Iodide SCHEMBL7354314 | 0.87 | F2 (0.40) | NQO2F10F2ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7352273 | 0.84 | NQO2 (0.43) | NQO2F10F2ITGB3ITGA2B | |
| SCHEMBL7356973 | 0.82 | USP14 (0.33) | — | |
| SCHEMBL7359107 | 0.81 | F2 (0.39) | F10F2ITGB3ITGA2BPRSS1 | |
| Hydrochloric Acid SCHEMBL7357141 | 0.81 | F2 (0.38) | F10F2ITGB3ITGA2BPRSS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999028297-A1 | SUBSTITUTED INDOLES, HAVING A THROMBIN INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-06-10 | — | — | WO | disclosed |