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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5274661 | 0.99 | CYP1A2 (0.67) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 | |
| SCHEMBL7076940 | 0.97 | CYP1A2 (0.68) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 | |
| SCHEMBL29005884 | 0.88 | CYP1A2 (0.74) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 | |
| SCHEMBL7092172 | 0.82 | ALOX15 (0.55) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 | |
| SCHEMBL28638703 | 0.82 | HTT (0.61) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 | |
| SCHEMBL27509034 | 0.80 | SMN1; SMN2 (0.68) | HTTALOX15SMN1; SMN2L3MBTL1LMNA | |
| Bromide SCHEMBL11522514 | 0.79 | SMN1; SMN2 (0.66) | HTTALOX15SMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL6642195 | 0.79 | L3MBTL1 (0.69) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 | |
| SCHEMBL7829044 | 0.78 | LMNA (0.59) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 | |
| Iodide SCHEMBL8930200 | 0.78 | ALOX15 (0.57) | CYP1A2CYP2C19HTTALOX15SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7855293-B2 | Fluorescent dyes such as 2-(4-acetanilino-1,3-butadieneyl)-3-spiro-1'-cyclohexan-1-(4-sulfobutyl)-3H -indolium hydroxide metal salts which couple biological materials without loss of fluorescence due to self-quenching | HAALCK LUTZ | 2010-12-21 | — | — | US | disclosed |
| US-20030138791-A1 | 3-Spiro-cyanin fluorochromes and their use in bioassays | HAALCK LUTZ (DE) | 2003-07-24 | — | — | 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-20030138791-A1 | 3-Spiro-cyanin fluorochromes and their use in bioassays | SPR, CBR3, CIAPIN1 | CYP1A2 3277/4885CYP2C19 3216/4885HTT 1598/4885 |
“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.