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 | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | GFER | P55789 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL2266998 | 0.98 | MAPT (0.46) | MAPTALDH1A1GFERGAAKDM4E | |
| Hydrochloric Acid SCHEMBL2541584 | 0.97 | MAPT (0.44) | MAPTALDH1A1GFERGAAKDM4E | |
| Hydrochloric Acid SCHEMBL6176240 | 0.97 | MAPT (0.46) | MAPTALDH1A1GFERGAAKDM4E | |
| Hydrochloric Acid SCHEMBL1154597 | 0.95 | MAPT (0.44) | MAPTALDH1A1GFERGAAKDM4E | |
| Hydrochloric Acid SCHEMBL6176242 | 0.95 | MAPT (0.44) | MAPTALDH1A1GFERGAAKDM4E | |
| Iodide SCHEMBL2533972 | 0.84 | MAPT (0.44) | MAPTALDH1A1GFERGAAKDM4E | |
| Hydrochloric Acid SCHEMBL6405819 | 0.83 | MAPT (0.43) | MAPTALDH1A1GFERGAAKDM4E | |
| SCHEMBL13790861 | 0.83 | ADRB1 (0.43) | MAPTALDH1A1KMT2AL3MBTL1USP2 | |
| SCHEMBL2267487 | 0.83 | MAPT (0.45) | MAPTALDH1A1GFERGAAKDM4E | |
| Iodide SCHEMBL2537434 | 0.82 | MAPT (0.42) | MAPTALDH1A1GFERGAAKDM4E |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1414392-A4 | PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR | CLAIROL INC (US) | 2004-07-14 | — | — | EP | disclosed |
| EP-1414392-A1 | PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR | Clairol Incorporated (US) | 2004-05-06 | — | — | EP | disclosed |
| US-6521761-B2 | For coloring hair | CLAIROL INCORPORATED | 2003-02-18 | — | — | US | disclosed |
| US-6461391-B1 | Primary intermediates for oxidative coloration of hair | CLAIROL INCORPORATED | 2002-10-08 | — | — | US | disclosed |
| US-20020106341-A1 | PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR | WELLA OPERATIONS US, LLC | 2002-08-08 | — | — | US | disclosed |
| WO-2002045675-A1 | PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR | P&G - CLAIROL, INC. (US) | 2002-06-13 | — | — | WO | 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-20020106341-A1 | PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR | CYC1, MT-CO1, PYCR1 | MAPT 4698/4885ALDH1A1 61/4885GFER 737/4885 |
“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.