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 | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | THRB | P10828 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | RECQL | P46063 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.43 |
| ▸ | ALPG | P10696 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7849455 | 0.98 | VDR (0.41) | MEN1MAPTTHRBKMT2ANPC1 | |
| SCHEMBL26782782 | 0.84 | TDP1 (0.43) | MEN1MAPTTHRBKMT2ANPC1 | |
| SCHEMBL26782797 | 0.81 | SMN1; SMN2 (0.47) | MEN1MAPTTHRBKMT2ANPC1 | |
| Iodide SCHEMBL20975473 | 0.80 | MEN1 (0.35) | MEN1MAPTTHRBKMT2ALMNA | |
| SCHEMBL26782791 | 0.80 | LTA4H (0.38) | MEN1MAPTTHRBKMT2ANPC1 | |
| SCHEMBL27278164 | 0.79 | RARA (0.38) | MEN1KMT2APOLBALDH1A1SMN1; SMN2 | |
| Iodide SCHEMBL20975474 | 0.79 | THRB (0.47) | MEN1MAPTTHRBKMT2ANPC1 | |
| Iodide SCHEMBL4701241 | 0.77 | MEN1 (0.42) | MEN1MAPTTHRBKMT2ANPC1 | |
| SCHEMBL29271029 | 0.77 | THRB (0.44) | MEN1MAPTTHRBKMT2ANPC1 | |
| Iodide SCHEMBL2587637 | 0.76 | MEN1 (0.48) | MEN1MAPTTHRBKMT2ALMNA |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11377562-B2 | Squaraine dyes and applications thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2022-07-05 | — | — | US | claimed |
| US-20190270889-A1 | SQUARAINE DYES AND APPLICATIONS THEREOF | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2019-09-05 | — | — | US | claimed |
| WO-2018020518-A1 | SQUARAINE DYES AND APPLICATIONS THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2018-02-01 | — | — | WO | claimed |
| CN-105733564-A | Mitochondrially-targeted pH-sensitive ratio-type fluorescent probe and preparation method and application thereof | 郑州大学 | 2016-07-06 | — | — | CN | claimed |
| US-11377562-B2 | Squaraine dyes and applications thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2022-07-05 | — | — | US | disclosed |
| EP-3307817-B1 | NOVEL SPIROPYRAN BASED COMPOSITION AND APPLICATION THEREOF AS SECURITY TAG | COUNCIL SCIENT IND RES (IN) | 2020-11-04 | — | — | EP | disclosed |
| US-10723883-B2 | Spiropyran based composition and application thereof as security tag | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2020-07-28 | — | — | US | disclosed |
| US-20190270889-A1 | SQUARAINE DYES AND APPLICATIONS THEREOF | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2019-09-05 | — | — | US | disclosed |
| US-20180163053-A1 | Novel Spiropyran Based Composition and Application Thereof as Security Tag | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2018-06-14 | — | — | US | disclosed |
| EP-3307817-A1 | NOVEL SPIROPYRAN BASED COMPOSITION AND APPLICATION THEREOF AS SECURITY TAG | Council of Scientific and Industrial Research (IN) | 2018-04-18 | — | — | EP | disclosed |
| WO-2018020518-A1 | SQUARAINE DYES AND APPLICATIONS THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2018-02-01 | — | — | WO | disclosed |
| WO-2016199173-A1 | NOVEL SPIROPYRAN BASED COMPOSITION AND APPLICATION THEREOF AS SECURITY TAG | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2016-12-15 | — | — | WO | disclosed |
| CN-105733564-A | Mitochondrially-targeted pH-sensitive ratio-type fluorescent probe and preparation method and application thereof | 郑州大学 | 2016-07-06 | — | — | CN | disclosed |
| US-20030095924-A1 | Galenical formulations | SCHERING AKTIENGESELLSCHAFT (DE) | 2003-05-22 | — | — | US | disclosed |
| US-6447749-B1 | Perfluoro-alkyl containing dye molecules and galencial formulations | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-09-10 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20030095924-A1 | Galenical formulations | GALR1, GALR2, LGALS1 | MEN1 1210/4885MAPT 1990/4885THRB 973/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.