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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | GNAO1 | P09471 | 5/20 | 0.38 |
| ▸ | GNAI3 | P08754 | 4/20 | 0.38 |
| ▸ | GNAI1 | P63096 | 4/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.36 |
| ▸ | GUSB | P08236 | 2/20 | 0.35 |
| ▸ | EBP | Q15125 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL11780016 | 1.00 | ALDH1A1 (0.41) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL1831029 | 0.98 | ALDH1A1 (0.43) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL2267104 | 0.98 | ALDH1A1 (0.43) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL1832672 | 0.98 | ALDH1A1 (0.43) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL1836046 | 0.98 | ALDH1A1 (0.43) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| Hydrochloric Acid SCHEMBL11786491 | 0.95 | GNAO1 (0.42) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL1831885 | 0.95 | ALDH1A1 (0.39) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL14464437 | 0.89 | S1PR1 (0.41) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL9214147 | 0.84 | S1PR1 (0.38) | ALDH1A1EPHX1GNAO1GNAI3GNAI1 | |
| SCHEMBL29288539 | 0.80 | S1PR1 (0.37) | EPHX1GNAO1GNAI3GNAI1S1PR1 |
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-3931129-A | FLUOROELASTOMER COMPOSITION | DAIKIN KOGYO CO., LTD. (JA) | 1976-01-06 | — | — | US | disclosed |