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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2150515 | 0.98 | NOS3 (0.39) | NOS3NOS2KDM4EPOLB | |
| SCHEMBL19412656 | 0.82 | NOS2 (0.48) | NOS3NOS2KDM4EPOLB | |
| Iodide SCHEMBL5085340 | 0.76 | GABRA1 (0.31) | — | |
| SCHEMBL10781528 | 0.76 | NOS3 (0.38) | NOS3NOS2 | |
| SCHEMBL26385366 | 0.75 | NOS3 (0.40) | NOS3NOS2KDM4EPOLB | |
| SCHEMBL6831030 | 0.73 | GABRA1 (0.32) | — | |
| SCHEMBL28241668 | 0.73 | SKP2 (0.37) | NOS2KDM4E | |
| Hydrochloric Acid SCHEMBL2965190 | 0.71 | GABRA1 (0.31) | — | |
| Bromide SCHEMBL5085462 | 0.71 | GABRA1 (0.31) | — | |
| SCHEMBL4076418 | 0.70 | NOS3 (0.40) | NOS3NOS2KDM4EPOLB |
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-3997611-A | Production of tertiary phosphine oxides | HOECHST AKTIENGESELLSCHAFT (DT) | 1976-12-14 | — | — | US | disclosed |