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 | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.45 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.41 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | AOC2 | O75106 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL3297378 | 0.95 | TAAR1 (0.54) | TAAR1PTGS1PTGS2MAOBIDO1 | |
| SCHEMBL7437052 | 0.80 | TAAR1 (0.68) | TAAR1PTGS1PTGS2MAOBIDO1 | |
| Iodide SCHEMBL2217317 | 0.78 | IDO1 (0.50) | TAAR1PTGS1PTGS2MAOBIDO1 | |
| SCHEMBL10574057 | 0.75 | TAAR1 (0.62) | TAAR1PTGS1PTGS2MAOBIDO1 | |
| SCHEMBL2320532 | 0.75 | TAAR1 (0.62) | TAAR1PTGS1PTGS2MAOBIDO1 | |
| Iodide SCHEMBL7548535 | 0.74 | ESR1 (0.65) | TAAR1PTGS1PTGS2L3MBTL1 | |
| Iodide SCHEMBL7547402 | 0.74 | CYP1A2 (0.54) | TAAR1IDO1C3AR1AGXTL3MBTL1 | |
| Iodide SCHEMBL7546993 | 0.74 | TSHR (0.43) | TAAR1L3MBTL1 | |
| Iodide SCHEMBL7552822 | 0.73 | TAAR1 (0.59) | TAAR1MAOBIDO1 | |
| SCHEMBL10571903 | 0.72 | TAAR1 (0.59) | TAAR1MAOBIDO1LOXL2AOC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6482990-B1 | Prostaglandin E analogues | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2002-11-19 | — | — | US | disclosed |
| EP-1211241-A1 | PROSTAGLANDIN E ANALOGUES | TAISHO PHARMACEUTICAL CO., LTD (JP) | 2002-06-05 | — | — | EP | disclosed |