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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | METAP2 | P50579 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL701691 | 0.98 | SIRT1 (0.60) | SIRT1HTTKMT2AGAAHPGD | |
| SCHEMBL5613062 | 0.82 | BCAT2 (0.53) | SIRT1HTTKMT2AGAAHPGD | |
| SCHEMBL9669181 | 0.80 | HTT (0.55) | HTTKMT2AGAAHPGDALDH1A1 | |
| SCHEMBL29530768 | 0.80 | SIRT1 (0.64) | SIRT1KMT2AGAAHPGDALDH1A1 | |
| SCHEMBL11821622 | 0.80 | SIRT1 (0.64) | SIRT1KMT2AGAAHPGDALDH1A1 | |
| SCHEMBL1399456 | 0.80 | SIRT1 (0.64) | SIRT1KMT2AGAAHPGDALDH1A1 | |
| SCHEMBL3077375 | 0.80 | SIRT1 (0.77) | SIRT1GAAHPGDALDH1A1MAPT | |
| SCHEMBL1559658 | 0.80 | PARP1 (0.46) | SIRT1HTTKMT2AGAAHPGD | |
| SCHEMBL7537538 | 0.79 | HTT (0.46) | HTTKMT2AGAAHPGDALDH1A1 | |
| SCHEMBL29391544 | 0.78 | POLB (0.68) | HTTKMT2AGAAHPGDALDH1A1 |
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-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |