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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 3/20 | 0.47 |
| ▸ | CCR1 | P32246 | 1/20 | 0.44 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 SCHEMBL9852255 | 0.92 | DRD4 (0.60) | DRD4ACHESMN1; SMN2MCHR1MAOB | |
| Iodide SCHEMBL9727148 | 0.81 | RAB9A (0.56) | DRD4ACHEALDH1A1NPC1RAB9A | |
| SCHEMBL9727095 | 0.80 | DRD4 (0.72) | DRD4ACHEALDH1A1SMN1; SMN2MCHR1 | |
| SCHEMBL9852101 | 0.80 | KMT2A (0.54) | DRD4ACHEALDH1A1NPC1RAB9A | |
| SCHEMBL9727078 | 0.76 | DRD4 (0.57) | DRD4MCHR1 | |
| SCHEMBL9852082 | 0.74 | DRD4 (0.73) | DRD4ACHEMCHR1MAOB | |
| SCHEMBL9852245 | 0.72 | DRD4 (0.55) | DRD4ACHEALDH1A1MCHR1MAOB | |
| SCHEMBL9727202 | 0.71 | KCNH2 (0.47) | DRD4ALDH1A1NPC1RAB9A | |
| SCHEMBL9727149 | 0.71 | DRD4 (0.58) | DRD4ALDH1A1SMN1; SMN2MCHR1MAOB | |
| Hydrochloric Acid SCHEMBL9343553 | 0.71 | HTR4 (0.48) | ALDH1A1NPC1RAB9ASMN1; SMN2MAOB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5098915-A | Antiarrhythmia agents | G. D. SEARLE & CO. (US) | 1992-03-24 | — | — | US | claimed |
| EP-0416581-A1 | Substituted N-benzylpiperidine amides | G.D. Searle & Co. (US) | 1991-03-13 | — | — | EP | claimed |