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 | |
|---|---|---|---|---|
| ▸ | KDM4A | O75164 | 5/20 | 0.66 |
| ▸ | KDM2A | Q9Y2K7 | 5/20 | 0.66 |
| ▸ | MEN1 | O00255 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | MAPT | P10636 | 4/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | GFER | P55789 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | ALPG | P10696 | 1/20 | 0.62 |
| ▸ | THRB | P10828 | 1/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | CASP1 | P29466 | 2/20 | 0.57 |
| ▸ | HBB | P68871 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.57 |
| ▸ | CASP7 | P55210 | 1/20 | 0.57 |
| ▸ | APP | P05067 | 5/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
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 SCHEMBL7034121 | 1.00 | KDM4A (0.66) | KDM4AKDM2AMEN1KMT2AMAPT | |
| SCHEMBL14984144 | 0.88 | KDM4A (0.73) | KDM4AKDM2AMEN1KMT2AMAPT | |
| SCHEMBL7733284 | 0.86 | KDM4A (0.52) | KDM4AKDM2AMEN1KMT2AMAPT | |
| Iodide SCHEMBL7034068 | 0.86 | KDM4A (0.54) | KDM4AKDM2AMEN1KMT2AMAPT | |
| Iodide SCHEMBL7032594 | 0.86 | KDM4A (0.50) | KDM4AKDM2AMEN1KMT2AMAPT | |
| Iodide SCHEMBL7034072 | 0.86 | KDM4A (0.54) | KDM4AKDM2AMEN1KMT2AMAPT | |
| Iodide SCHEMBL7032588 | 0.86 | KDM4A (0.50) | KDM4AKDM2AMEN1KMT2AMAPT | |
| SCHEMBL13645407 | 0.84 | KDM4A (0.84) | KDM4AKDM2AMEN1KMT2AMAPT | |
| SCHEMBL14984138 | 0.84 | KDM4A (0.79) | KDM4AKDM2AMEN1KMT2AMAPT | |
| Iodide SCHEMBL7035365 | 0.84 | CHRM2 (0.60) | KDM4AKDM2AMEN1KMT2AMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030022105-A1 | TWO -PHOTON UPCONVERTING DYES AND APPLICATIONS | PRASAD PARAS N (US) | 2003-01-30 | — | — | US | disclosed |
| US-6402037-B1 | Two-photon upconverting dyes and applications | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK | 2002-06-11 | — | — | US | disclosed |
| EP-0862432-A1 | TWO-PHOTON UPCONVERTING DYES AND APPLICATIONS | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1998-09-09 | — | — | EP | disclosed |
| WO-1997009043-A1 | TWO-PHOTON UPCONVERTING DYES AND APPLICATIONS | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1997-03-13 | — | — | WO | disclosed |