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 | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | ESR1 | P03372 | 4/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 3/20 | 0.33 |
| ▸ | CES1 | P23141 | 3/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5157031 | 0.98 | CYP3A4 (0.60) | CYP3A4TDP1ESR1ESR2HPGD | |
| SCHEMBL457472 | 0.87 | CYP3A4 (0.67) | CYP3A4TDP1ESR1ESR2HPGD | |
| Butane SCHEMBL27989459 | 0.85 | CYP3A4 (0.71) | CYP3A4TDP1ESR1ESR2HPGD | |
| Butane SCHEMBL28244852 | 0.85 | CYP3A4 (0.71) | CYP3A4TDP1ESR1ESR2HPGD | |
| SCHEMBL9862135 | 0.85 | CYP3A4 (0.50) | CYP3A4TDP1ESR1ESR2HPGD | |
| SCHEMBL2505239 | 0.83 | CYP3A4 (0.48) | CYP3A4TDP1ESR1ESR2TP53 | |
| SCHEMBL11728287 | 0.83 | CYP3A4 (0.48) | CYP3A4TDP1ESR1ESR2TP53 | |
| Propane SCHEMBL27796760 | 0.82 | CYP3A4 (0.75) | CYP3A4TDP1ESR1ESR2HPGD | |
| Propane SCHEMBL28233649 | 0.82 | CYP3A4 (0.75) | CYP3A4TDP1ESR1ESR2HPGD | |
| SCHEMBL293241 | 0.82 | CYP3A4 (0.75) | CYP3A4TDP1ESR1ESR2HPGD |
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-8420865-B2 | Phosphine compound, process for producing the same, and peroxide scavenger using the same | FUKUOKA UNIVERSITY (JP) | 2013-04-16 | — | — | US | disclosed |
| US-20110015440-A1 | PHOSPHINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND PEROXIDE SCAVENGER USING THE SAME | FUKUOKA UNIVERSITY (JP) | 2011-01-20 | — | — | 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-20110015440-A1 | PHOSPHINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND PEROXIDE SCAVENGER USING THE SAME | FECH, PRDX5, MTCH2 | CYP3A4 2098/4885TDP1 2808/4885ESR1 3667/4885 |
“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.