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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.46 |
| ▸ | SHBG | P04278 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5489439 | 0.97 | TAAR1 (0.54) | TAAR1PTGS1PTGS2TSHRACHE | |
| SCHEMBL40576 | 0.97 | — | — | |
| SCHEMBL29458957 | 0.97 | — | — | |
| SCHEMBL31498537 | 0.94 | TAAR1 (0.52) | TAAR1PTGS1PTGS2TSHRACHE | |
| SCHEMBL27581098 | 0.94 | TAAR1 (0.52) | TAAR1PTGS1PTGS2TSHRACHE | |
| SCHEMBL5157331 | 0.94 | TAAR1 (0.52) | TAAR1PTGS1PTGS2TSHRACHE | |
| Ammonia Solution, Strong SCHEMBL5005672 | 0.94 | TAAR1 (0.52) | TAAR1PTGS1PTGS2TSHRACHE | |
| O-Xylene SCHEMBL9356149 | 0.94 | TSHR (0.56) | TAAR1PTGS1PTGS2TSHRACHE | |
| Ammonia Solution, Strong SCHEMBL9453011 | 0.94 | TAAR1 (0.52) | TAAR1PTGS1PTGS2TSHRACHE | |
| Methane SCHEMBL28281016 | 0.94 | TAAR1 (0.52) | TAAR1PTGS1PTGS2TSHRACHE |
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 |
|---|---|---|---|---|---|---|---|
| CN-103918050-B | Dye-sensitized solar cell | 株式会社艾迪科 | 2016-12-07 | — | — | CN | disclosed |