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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17916653 | 0.99 | LTA4H (0.40) | LTA4HNR5A1TSHRNPC1RAB9A | |
| Bicarbonate SCHEMBL17911341 | 0.91 | TP53 (0.39) | TSHRTP53 | |
| Iodide SCHEMBL18824159 | 0.89 | FGFR1 (0.38) | NPC1RAB9ATP53GAAFGFR1 | |
| Bicarbonate SCHEMBL29765454 | 0.82 | TP53 (0.41) | TSHRTP53 | |
| Bicarbonate SCHEMBL29765538 | 0.82 | TP53 (0.41) | TSHRTP53 | |
| Bicarbonate SCHEMBL26607957 | 0.82 | TP53 (0.41) | TSHRTP53 | |
| Bicarbonate SCHEMBL26607969 | 0.82 | TP53 (0.41) | TSHRTP53 | |
| SCHEMBL23366511 | 0.81 | ADRB2 (0.33) | — | |
| SCHEMBL18844586 | 0.80 | APAF1 (0.38) | LTA4HCASRLMNAMAPTAPAF1 | |
| SCHEMBL23366502 | 0.75 | ABCG2 (0.39) | — |
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-11840766-B2 | Etching metal using N-heterocyclic carbenes | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2023-12-12 | — | — | US | disclosed |