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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.35 |
| ▸ | RAPGEF3 | O95398 | 1/20 | 0.35 |
| ▸ | GRN | P28799 | 6/20 | 0.35 |
| ▸ | SORT1 | Q99523 | 6/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | UBE2M | P61081 | 1/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 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 SCHEMBL1440189 | 1.00 | GRM4 (0.37) | GRM4RAPGEF4RAPGEF3GRNSORT1 | |
| Iodide SCHEMBL1440193 | 1.00 | GRM4 (0.37) | GRM4RAPGEF4RAPGEF3GRNSORT1 | |
| SCHEMBL9962405 | 0.90 | GRN (0.42) | GRNSORT1MAPK1KDM4EGAA | |
| SCHEMBL1531587 | 0.82 | GRM4 (0.41) | GRM4RAPGEF4RAPGEF3GRNSORT1 | |
| SCHEMBL1531584 | 0.82 | GRM4 (0.41) | GRM4RAPGEF4RAPGEF3GRNSORT1 | |
| SCHEMBL28104638 | 0.79 | GRM4 (0.41) | GRM4RAPGEF4RAPGEF3GRNSORT1 | |
| SCHEMBL1439322 | 0.76 | GRM4 (0.39) | GRM4RAPGEF4RAPGEF3GRNSORT1 | |
| SCHEMBL1439320 | 0.76 | GRM4 (0.39) | GRM4RAPGEF4RAPGEF3GRNSORT1 | |
| SCHEMBL25042405 | 0.71 | GRN (0.42) | GRM4GRNSORT1MAPK1KDM4E | |
| SCHEMBL9962440 | 0.71 | RAB9A (0.49) | GRNSORT1MAPK1GAARAB9A |
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-112300172-B | Bruton tyrosine kinase inhibitors | 比奥根MA公司 | 2024-01-16 | — | — | CN | disclosed |