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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 3/20 | 0.54 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.54 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.49 |
| ▸ | SCN1A | P35498 | 3/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
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 SCHEMBL11064087 | 0.88 | ADRB1 (0.51) | ADRB1ADRB2HTR1AOPRK1SLC18A3 | |
| Iodide SCHEMBL11063509 | 0.84 | ADRB1 (0.54) | ADRB1ADRB2HTR1AOPRK1SCN1A | |
| Iodide SCHEMBL11068796 | 0.83 | SLC18A3 (0.45) | ADRB1ADRB2HTR1AOPRK1SLC18A3 | |
| Iodide SCHEMBL11071817 | 0.82 | SLC18A3 (0.46) | ADRB1ADRB2HTR1AOPRK1SLC18A3 | |
| SCHEMBL11061316 | 0.80 | SCN5A (0.69) | ADRB1ADRB2HTR1AOPRK1SLC18A3 | |
| Hydrochloric Acid SCHEMBL11065038 | 0.79 | MAOB (0.48) | SLC18A3 | |
| Iodide SCHEMBL11060156 | 0.78 | SLC18A3 (0.45) | ADRB1ADRB2SLC18A3KCNH2APOBEC3A | |
| Hydrochloric Acid SCHEMBL11070395 | 0.77 | SLC18A3 (0.46) | ADRB1ADRB2HTR1AOPRK1SLC18A3 | |
| Iodide SCHEMBL11071830 | 0.77 | SLC18A3 (0.44) | ADRB1ADRB2SLC18A3SCN1ASCN5A | |
| SCHEMBL11066967 | 0.75 | SCN1A (0.55) | ADRB1ADRB2HTR1AOPRK1SLC18A3 |
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-4482560-A | Carbostyril derivatives, and antihistaminic agents containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1984-11-13 | — | — | US | disclosed |