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 | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | CMKLR1 | Q99788 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 SCHEMBL8702484 | 0.88 | MEN1 (0.31) | MEN1KMT2AKDM4EGMNNALDH1A1 | |
| Iodide SCHEMBL8702586 | 0.76 | ALDH1A1 (0.42) | KDM4EALDH1A1LMNAPOLBMAPT | |
| Iodide SCHEMBL8697992 | 0.76 | CES2 (0.44) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| Iodide SCHEMBL8700644 | 0.74 | CTSD (0.45) | KMT2AALDH1A1LMNAMAPTHPGD | |
| SCHEMBL9171525 | 0.72 | ALDH1A1 (0.46) | MEN1KMT2AKDM4EALDH1A1POLB | |
| SCHEMBL8055106 | 0.70 | ALDH1A1 (0.42) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL8696670 | 0.68 | HTT (0.42) | MEN1KMT2AALDH1A1LMNAMAPT | |
| SCHEMBL14040090 | 0.67 | TSHR (0.45) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL8055104 | 0.67 | L3MBTL1 (0.46) | KMT2AALDH1A1HPGD | |
| Iodide SCHEMBL8698072 | 0.67 | GSK3B (0.49) | KMT2AKDM4EALDH1A1LMNAHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998003478-A1 | NITRONE DERIVATIVES, PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION, AND THEIR USE AS HERBICIDES | RHONE-POULENC AGRICULTURE LTD. (GB) | 1998-01-29 | — | — | WO | disclosed |