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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | PTAFR | P25105 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.45 |
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 SCHEMBL9693243 | 0.91 | ADRA1D (0.54) | ADRA1DPTAFRHTR1DHTR2CADRA1B | |
| Hydrochloric Acid SCHEMBL9863873 | 0.90 | ADRA1D (0.43) | ADRA1DPTAFRHTR1DHTR2CADRA1B | |
| Hydrochloric Acid SCHEMBL9863905 | 0.89 | ADRA1D (0.54) | ADRA1DPTAFRHTR1DHTR2CADRA1B | |
| Hydrochloric Acid SCHEMBL9863634 | 0.86 | DNM1 (0.36) | — | |
| Hydrochloric Acid SCHEMBL9863421 | 0.82 | LPAR5 (0.43) | ADRA1DPTAFRHTR1DHTR2CADRA1B | |
| Iodide SCHEMBL9863389 | 0.82 | PRKD3 (0.44) | — | |
| Iodide SCHEMBL9863345 | 0.81 | PLA2G2C (0.53) | — | |
| SCHEMBL9863415 | 0.79 | ADRA1D (0.44) | ADRA1DPTAFRHTR1DHTR2CADRA1B | |
| Bromide SCHEMBL9863740 | 0.77 | — | — | |
| SCHEMBL11014451 | 0.74 | PRKD3 (0.41) | ADRA1DPTAFRHTR1DHTR2CADRA1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5025005-A | Preventive or therapeutic agents for circulatory diseases, allergic disorders; antineoplastic agent; inhibitor for platelet activating factor | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1991-06-18 | — | — | US | disclosed |
| US-4737518-A | ANTIALLERGENS, ANTINEOPLASTICS, ANTICOAGULANTS, CIRCULATORY DISEASES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1988-04-12 | — | — | US | disclosed |
| EP-0157609-A2 | Lipid derivatives their production and use | Takeda Chemical Industries, Ltd. (JP) | 1985-10-09 | — | — | EP | disclosed |