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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 7/20 | 0.68 |
| ▸ | HTT | P42858 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.49 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.49 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL21529330 | 0.96 | DNM1 (0.71) | DNM1HTTKMT2AMEN1THRB | |
| SCHEMBL29352912 | 0.91 | DNM1 (0.64) | DNM1HTTKMT2AMEN1THRB | |
| Iodide SCHEMBL10492728 | 0.88 | HTT (0.65) | DNM1HTTKMT2AMEN1THRB | |
| SCHEMBL21530871 | 0.88 | HTT (0.64) | DNM1HTTKMT2AMEN1THRB | |
| Iodide SCHEMBL8912350 | 0.87 | DNM1 (0.55) | DNM1HTTKMT2AMEN1THRB | |
| Iodide SCHEMBL8912913 | 0.86 | DNM1 (0.58) | DNM1HTTKMT2AMEN1THRB | |
| SCHEMBL29377128 | 0.85 | DNM1 (0.57) | DNM1HTTKMT2AMEN1THRB | |
| Iodide SCHEMBL9487887 | 0.84 | DNM1 (0.95) | DNM1HTTKMT2AHSP90AA1PSMD14 | |
| SCHEMBL668100 | 0.83 | DNM1 (0.59) | DNM1HTTKMT2AMEN1THRB | |
| SCHEMBL23011529 | 0.82 | DNM1 (1.00) | DNM1HTTKMT2AHSP90AA1PSMD14 |
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-5614548-A | TREATING TUMORS AND HIV INFECTION, PROTEIN KINASE C INHIBITORS | WAKE FOREST UNIVERSITY (US) | 1997-03-25 | — | — | US | disclosed |
| WO-1990004918-A2 | QUATERNARY AMINE CONTAINING ETHER OR ESTER LIPID DERIVATIVES AND THERAPEUTIC COMPOSITIONS | WAKE FOREST UNIVERSITY (US) | 1990-05-17 | — | — | WO | disclosed |