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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 5/20 | 0.60 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | MCHR1 | Q99705 | 7/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CCR3 | P51677 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
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 SCHEMBL9727152 | 0.92 | DRD4 (0.47) | DRD4MCHR1MAOBACHESMN1; SMN2 | |
| SCHEMBL9727095 | 0.91 | DRD4 (0.72) | DRD4SIGMAR1MCHR1MAOBACHE | |
| Iodide SCHEMBL9852252 | 0.84 | DRD4 (0.59) | DRD4SIGMAR1MCHR1MAOBACHE | |
| SCHEMBL9852082 | 0.82 | DRD4 (0.73) | DRD4SIGMAR1MCHR1MAOBACHE | |
| SCHEMBL9727149 | 0.81 | DRD4 (0.58) | DRD4SIGMAR1MCHR1MAOBSMN1; SMN2 | |
| SCHEMBL9727135 | 0.81 | DRD4 (0.67) | DRD4SIGMAR1MCHR1MAOB | |
| Dimethylamine SCHEMBL9852061 | 0.80 | DRD4 (0.63) | DRD4SIGMAR1MCHR1MAOB | |
| SCHEMBL9727123 | 0.80 | DRD4 (0.69) | DRD4SIGMAR1MCHR1MAOBSMN1; SMN2 | |
| SCHEMBL9727173 | 0.80 | SIGMAR1 (0.57) | DRD4SIGMAR1MCHR1MAOBACHE | |
| SCHEMBL9727235 | 0.80 | DRD4 (0.58) | DRD4SIGMAR1MCHR1MAOBACHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-0416581-A1 | Substituted N-benzylpiperidine amides | G.D. Searle & Co. (US) | 1991-03-13 | — | — | EP | claimed |