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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 11/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CYP26A1 | O43174 | 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 | |
|---|---|---|---|---|
| SCHEMBL27663505 | 0.98 | CYP17A1 (0.48) | CYP17A1TBXAS1CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL27683095 | 0.93 | CYP17A1 (0.43) | CYP17A1TBXAS1CYP19A1CYP1A2CYP3A4 | |
| SCHEMBL27759709 | 0.92 | TBXAS1 (0.46) | CYP17A1TBXAS1CYP19A1CYP3A4CYP2D6 | |
| SCHEMBL19831940 | 0.92 | TBXAS1 (0.46) | CYP17A1TBXAS1CYP19A1CYP3A4CYP2D6 | |
| SCHEMBL27663508 | 0.92 | TBXAS1 (0.46) | CYP17A1TBXAS1CYP19A1CYP3A4CYP2D6 | |
| SCHEMBL27759708 | 0.92 | TBXAS1 (0.46) | CYP17A1TBXAS1CYP19A1CYP3A4CYP2D6 | |
| Bromide SCHEMBL28492540 | 0.90 | TBXAS1 (0.45) | CYP17A1TBXAS1CYP19A1CYP3A4CYP2D6 | |
| SCHEMBL11216145 | 0.81 | CYP17A1 (0.46) | CYP17A1TBXAS1CYP19A1 | |
| SCHEMBL17414701 | 0.80 | CYP17A1 (0.50) | CYP17A1TBXAS1CYP19A1 | |
| SCHEMBL2385238 | 0.80 | CYP17A1 (0.50) | CYP17A1TBXAS1CYP19A1 |
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-1970641-A | Dye for use in dye sensitized photovoltaic cell and ye sensitized photovoltaic cell | SAMSUNG SDI CO LTD (KR) | 2007-05-30 | — | — | CN | disclosed |