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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | DNM1 | Q05193 | 7/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
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 SCHEMBL15541314 | 1.00 | TSHR (0.57) | TSHRTHRBDNM1ALDH1A1LMNA | |
| Iodide SCHEMBL395473 | 1.00 | — | — | |
| SCHEMBL28436423 | 0.96 | TSHR (0.61) | TSHRTHRBDNM1ALDH1A1LMNA | |
| SCHEMBL21835154 | 0.96 | TSHR (0.61) | TSHRTHRBDNM1ALDH1A1LMNA | |
| SCHEMBL1576030 | 0.96 | — | — | |
| Iodide SCHEMBL7684635 | 0.96 | — | — | |
| SCHEMBL8136903 | 0.96 | TSHR (0.61) | TSHRTHRBDNM1ALDH1A1LMNA | |
| SCHEMBL5696337 | 0.96 | TSHR (0.61) | TSHRTHRBDNM1ALDH1A1LMNA | |
| SCHEMBL964127 | 0.96 | — | — | |
| SCHEMBL11660299 | 0.96 | TSHR (0.61) | TSHRTHRBDNM1ALDH1A1LMNA |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002096913-A1 | SUBSTITUTED DI(HYDROXY/ALKOXY)SILICON PHTHALOCYANINES AND THEIR USES | GENTIAN AS (NO) | 2002-12-05 | — | — | WO | disclosed |
| EP-1238016-A1 | SUBSTITUTED PHTHALOCYANINES AND THEIR PRECURSORS | Gentian AS (NO) | 2002-09-11 | — | — | EP | disclosed |
| WO-2001042368-A1 | SUBSTITUTED PHTHALOCYANINES AND THEIR PRECURSORS | GENTIAN AS (NO) | 2001-06-14 | — | — | WO | disclosed |
| US-4086280-A | FROM M-CHLOROPERBENZOIC ACID AND AN ALKYL ALKENYL TIN COMPOUND TO FORM EPOXIDE, HYDROGEN CHLORIDE | THE PROCTER & GAMBLE COMPANY (US) | 1978-04-25 | — | — | US | disclosed |
| US-4085273-A | REACTING TRIBUTYL(1-CARBOALKOXY-2,2-DIMETHYL-3-BUTEN-1-YL)TIN WITH ACETYL FLUOBORATE, REACTING PRODUCT WITH METHYL METAL COMPOUND, DEHYDRATING PRODUCT WITH IODINE CATALYSIS | THE PROCTER & GAMBLE COMPANY (US) | 1978-04-18 | — | — | US | disclosed |
| US-4065480-A | Process for preparing substituted cyclopropycarbinyl compounds | THE PROCTER & GAMBLE COMPANY (US) | 1977-12-27 | — | — | US | disclosed |
| US-3998889-A | REACTING AN UNSATURATED ORGANO-TIN COMPOUND WITH AN ORGANIC SULFUR HALIDE | THE PROCTER & GAMBLE COMPANY (US) | 1976-12-21 | — | — | US | disclosed |
| US-3959324-A | PESTICIDE, ANTIINFLAMMATORY | THE PROCTER & GAMBLE COMPANY (US) | 1976-05-25 | — | — | US | disclosed |