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 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | HSD17B3 | P37058 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 4/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 4/20 | 0.38 |
| ▸ | CA7 | P43166 | 4/20 | 0.38 |
| ▸ | CA9 | Q16790 | 4/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5144207 | 0.98 | LMNA (0.44) | LMNAHSD17B10PDPK1HSD17B3ALDH1A1 | |
| SCHEMBL11022263 | 0.86 | LIG1 (0.49) | LMNAHSD17B10PDPK1ALDH1A1MAPT | |
| Iodide SCHEMBL2353850 | 0.84 | MDM2 (0.47) | LMNAALDH1A1MAPTHPGDHTT | |
| Iodide SCHEMBL9635124 | 0.82 | CA5A (0.41) | MAPTCA12CA1CA2CA7 | |
| SCHEMBL2221653 | 0.81 | MDM2 (0.48) | LMNAALDH1A1MAPTHPGDHTT | |
| Iodide SCHEMBL9636197 | 0.81 | KDM4E (0.54) | MAPTSLC6A2SLC6A3CA12CA1 | |
| SCHEMBL9635153 | 0.80 | CA5A (0.42) | LMNAMAPTCA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL2356480 | 0.80 | MDM2 (0.47) | LMNAALDH1A1MAPTHPGDHTT | |
| Water SCHEMBL16320768 | 0.80 | MDM2 (0.47) | LMNAALDH1A1MAPTHPGDHTT | |
| Bromide SCHEMBL2356766 | 0.80 | MDM2 (0.47) | LMNAALDH1A1MAPTHPGDHTT |
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 |
|---|---|---|---|---|---|---|---|
| JP-57021352-A | — | — | None | — | — | JP | disclosed |
| JP-S5721352-A | NOVEL SUBSTANCE FOR MEASURING CHOLINEESTERASE ACTIVITY AND METHOD THEREOF | SHINOTESUTO KENKYUSHO:KK | 1982-02-04 | — | — | JP | disclosed |