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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 9/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 2/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 8/20 | 0.38 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
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 SCHEMBL6401114 | 1.00 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| Iodide SCHEMBL2540456 | 1.00 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| Iodide SCHEMBL2540172 | 1.00 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| Iodide SCHEMBL2542756 | 1.00 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| Iodide SCHEMBL2537383 | 1.00 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| Iodide SCHEMBL6400132 | 1.00 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| Iodide SCHEMBL2540978 | 1.00 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| SCHEMBL2268631 | 0.99 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| SCHEMBL2265915 | 0.99 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT | |
| SCHEMBL2266681 | 0.99 | GRM2 (0.43) | GRM2DPP4KDM4EGAAMAPT |
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-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 |