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 | |
|---|---|---|---|---|
| ▸ | INSR | P06213 | 12/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | APAF1 | O14727 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11632202 | 0.97 | INSR (0.56) | INSRMAPTMEN1KMT2ANPC1 | |
| Bromide SCHEMBL11633217 | 0.97 | INSR (0.56) | INSRMAPTMEN1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL11629281 | 0.89 | INSR (0.46) | INSRMAPTMEN1KMT2ANPC1 | |
| Bromide SCHEMBL11627911 | 0.82 | MAPT (0.54) | INSRMAPTMEN1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL11633252 | 0.82 | MAPT (0.56) | INSRMAPTMEN1KMT2ANPC1 | |
| SCHEMBL16520750 | 0.81 | INSR (0.60) | INSRMAPTMEN1KMT2ANPC1 | |
| Iodide SCHEMBL10886850 | 0.76 | KDM4E (0.63) | INSRMAPTMEN1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL11516462 | 0.76 | INSR (0.67) | INSRMAPTMEN1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL11516460 | 0.76 | INSR (0.67) | INSRMAPTMEN1KMT2ANPC1 | |
| Iodide SCHEMBL11631709 | 0.76 | ADRB2 (0.50) | INSRMAPTMEN1KMT2ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4085112-A | 2-Formyl-3-alkyl-benzothiazolium halide oxime | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1978-04-18 | — | — | US | disclosed |