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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 5/20 | 0.42 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALPG | P10696 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL840717 | 0.97 | ACHE (0.43) | ACHEBCHELMNATSHRALOX12 | |
| Hydrochloric Acid SCHEMBL29103228 | 0.95 | ACHE (0.42) | ACHEBCHELMNATSHRALOX12 | |
| Hydrochloric Acid SCHEMBL29103227 | 0.95 | ACHE (0.42) | ACHEBCHELMNATSHRALOX12 | |
| Hydrochloric Acid SCHEMBL4727803 | 0.95 | ACHE (0.42) | ACHEBCHELMNATSHRALOX12 | |
| SCHEMBL28799098 | 0.89 | ACHE (0.39) | ACHEBCHELMNATSHRALOX12 | |
| Hydrochloric Acid SCHEMBL29103122 | 0.89 | RAB9A (0.43) | ACHEBCHELMNATSHRALOX12 | |
| SCHEMBL776579 | 0.84 | NPC1 (0.37) | ACHEALDH1A1KDM4EHTTRAB9A | |
| Acetic Acid SCHEMBL29025324 | 0.83 | CES2 (0.39) | ACHEBCHELMNATDP1ALDH1A1 | |
| Iodide SCHEMBL1502849 | 0.80 | ACHE (0.48) | ACHEBCHELMNATSHRALOX12 | |
| SCHEMBL23058911 | 0.79 | SLC22A2 (0.48) | ACHEBCHELMNATSHRALOX12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0261380-B1 | FUSIBLE, ELECTRICALLY CONDUCTIVE TCNQ COMPLEXES, PROCESS FOR THEIR PREPARATION, AND THEIR USE | BAYER AG (DE) | 1990-10-03 | — | — | EP | disclosed |
| US-4849520-A | Fusible, electrically conductive TCNQ complexes, methods for their preparation and their application | BAYER AKTIENGESELLSCHAFT (DE) | 1989-07-18 | — | — | US | disclosed |
| EP-0261380-A1 | Fusible, electrically conductive TCNQ complexes, process for their preparation, and their use | BAYER AG (DE) | 1988-03-30 | — | — | EP | disclosed |