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 | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.46 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | LAP3 | P28838 | 2/20 | 0.45 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.45 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.45 |
| ▸ | GMNN | O75496 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | MTOR | P42345 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5536187 | 0.97 | OPRM1 (0.55) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL28208768 | 0.97 | OPRM1 (0.55) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL14722141 | 0.97 | OPRM1 (0.55) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL4373469 | 0.97 | OPRM1 (0.55) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL4220437 | 0.97 | OPRM1 (0.55) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL23093680 | 0.97 | OPRM1 (0.55) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL28260426 | 0.95 | OPRM1 (0.52) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL901170 | 0.95 | — | — | |
| Bromomethane SCHEMBL5036294 | 0.92 | OPRM1 (0.50) | OPRM1SPHK1LCKPPARDZDHHC20 | |
| SCHEMBL2231220 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109705172-A | The preparation method of heteronuclear metal complex and its cyclic carbonate ester of catalysis | 苏州大学 | 2019-05-03 | — | — | CN | disclosed |