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 | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 3/20 | 0.43 |
| ▸ | CHRM3 known ✓ | P20309 | 2/20 | 0.37 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | SLC22A16 | Q86VW1 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | GALR3 | O60755 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.37 |
| ▸ | CPT2 | P23786 | 1/20 | 0.37 |
| ▸ | CPT1A | P50416 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL52510 | 0.97 | MAPT (0.46) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| Hydrochloric Acid SCHEMBL9486928 | 0.95 | MAPT (0.50) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| Dimethylcarbate SCHEMBL8064789 | 0.83 | SLC22A16 (0.45) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| SCHEMBL29574838 | 0.80 | TSHR (0.40) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| Iodide SCHEMBL10588910 | 0.77 | SLC22A16 (0.43) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| SCHEMBL2269116 | 0.75 | CHRM2 (0.45) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| Iodide SCHEMBL11431896 | 0.75 | MAPT (0.41) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| Iodide SCHEMBL23012031 | 0.74 | MAPT (0.34) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| SCHEMBL5582502 | 0.74 | MAPT (0.44) | MAPTSLC22A16TSHRCHRM2CHRM4 | |
| SCHEMBL675895 | 0.74 | LMNA (0.46) | MAPTSLC22A16TSHRCHRM2CHRM4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE38460-E1 | Huperzine A derivatives, their preparation and their use | SHANGHAI INSTITUTE OF MATERIA MEDICA CHINESE ACADEMY OF SCIENCES (CN) | 2004-03-09 | — | — | US | disclosed |
| EP-0806416-B1 | HUPERZINE A DERIVATIVES, THEIR PREPARATION AND THEIR USE | SHANGAHI INST MATERIA MEDICA (CN) | 2003-05-07 | — | — | EP | disclosed |
| US-5929084-A | Huperzine A derivatives, their preparation and their use | SHANGAHI INSTITUTE OF MATERIA MEDICA CHINESE ACADEMY OF SCIENCES (CN) | 1999-07-27 | — | — | US | disclosed |
| EP-0806416-A1 | HUPERZINE A DERIVATIVES, THEIR PREPARATION AND THEIR USE | TSUMURA & CO. (JP) | 1997-11-12 | — | — | EP | disclosed |