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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.60 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | WNT3A | P56704 | 3/20 | 0.48 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.47 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.47 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.47 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.47 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.47 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.47 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.45 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.45 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.45 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.45 |
| ▸ | CCNC | P24863 | 1/20 | 0.45 |
| ▸ | CDK8 | P49336 | 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 | |
|---|---|---|---|---|
| SCHEMBL31119862 | 0.98 | DYRK1A (0.62) | DYRK1AUHRF1LMNAMAPTHTT | |
| SCHEMBL8964255 | 0.98 | DYRK1A (0.62) | DYRK1AUHRF1LMNAMAPTHTT | |
| Hydrochloric Acid SCHEMBL30657718 | 0.95 | DYRK1A (0.60) | DYRK1AUHRF1LMNAMAPTHTT | |
| Iodide SCHEMBL9618570 | 0.91 | DYRK1A (0.63) | DYRK1AUHRF1WNT3ANFATC1PSEN1 | |
| SCHEMBL30308690 | 0.88 | DYRK1A (0.65) | DYRK1AUHRF1WNT3ANFATC1PSEN1 | |
| SCHEMBL1896511 | 0.88 | DYRK1A (0.65) | DYRK1AUHRF1WNT3ANFATC1PSEN1 | |
| Iodide SCHEMBL28741643 | 0.84 | DYRK1A (0.58) | DYRK1AUHRF1WNT3APSEN1PSEN2 | |
| SCHEMBL134658 | 0.82 | DYRK1A (0.60) | DYRK1AUHRF1WNT3APSEN1PSEN2 | |
| SCHEMBL30559511 | 0.82 | DYRK1A (0.60) | DYRK1AUHRF1WNT3APSEN1PSEN2 | |
| SCHEMBL6855459 | 0.82 | DYRK1A (0.66) | DYRK1AUHRF1WNT3APSEN1PSEN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109796396-A | A kind of preparation method of N- methyl -4,4 '-bipyridyl iodide | 山西医科大学 | 2019-05-24 | — | — | CN | claimed |
| CN-109796396-A | A kind of preparation method of N- methyl -4,4 '-bipyridyl iodide | 山西医科大学 | 2019-05-24 | — | — | CN | disclosed |
| CN-109796396-A | A kind of preparation method of N- methyl -4,4 '-bipyridyl iodide | 山西医科大学 | 2019-05-24 | — | — | CN | disclosed |
| CN-109796396-A | A kind of preparation method of N- methyl -4,4 '-bipyridyl iodide | 山西医科大学 | 2019-05-24 | — | — | CN | disclosed |