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 | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 2/20 | 0.95 |
| ▸ | F12 | P00748 | 2/20 | 0.95 |
| ▸ | NCF1 | P14598 | 2/20 | 0.95 |
| ▸ | NOS3 | P29474 | 1/20 | 0.95 |
| ▸ | NOS1 | P29475 | 1/20 | 0.95 |
| ▸ | NOS2 | P35228 | 1/20 | 0.95 |
| ▸ | BACE1 | P56817 | 1/20 | 0.95 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.50 |
| ▸ | PLG | P00747 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL49220 | 0.98 | PLAU (1.00) | PLAUF12NCF1NOS3NOS1 | |
| SCHEMBL29377365 | 0.98 | PLAU (1.00) | PLAUF12NCF1NOS3NOS1 | |
| SCHEMBL28116864 | 0.95 | PLAU (0.95) | PLAUF12NCF1NOS3NOS1 | |
| Hydrochloric Acid SCHEMBL509104 | 0.95 | PLAU (0.95) | PLAUF12NCF1NOS3NOS1 | |
| Formic Acid SCHEMBL30738145 | 0.86 | F12 (0.78) | PLAUF12NCF1NOS3NOS1 | |
| Quinoline SCHEMBL28251904 | 0.85 | NCF1 (0.75) | PLAUF12NCF1NOS3NOS1 | |
| Benzamide SCHEMBL19877173 | 0.80 | PLAU (0.68) | PLAUF12NCF1NOS3NOS1 | |
| Methylglyoxal SCHEMBL6002250 | 0.80 | F12 (0.68) | PLAUF12NCF1NOS3NOS1 | |
| SCHEMBL3851423 | 0.79 | F12 (0.66) | PLAUF12NCF1NOS3NOS1 | |
| Hydrochloric Acid SCHEMBL27774395 | 0.79 | F12 (0.66) | PLAUF12NCF1NOS3NOS1 |
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-2022214044-A1 | AMINE-SUBSTITUTED PYRIDINE FUSED RING COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2022-10-13 | — | — | WO | disclosed |