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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 7/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11844558 | 0.98 | — | — | |
| Iodide SCHEMBL11646271 | 0.93 | EPHX1 (0.45) | EPHX1SPHK1 | |
| SCHEMBL6543354 | 0.91 | EPHX1 (0.46) | EPHX1SPHK1 | |
| Iodide SCHEMBL11683597 | 0.86 | — | — | |
| SCHEMBL8244841 | 0.83 | — | — | |
| Iodide SCHEMBL11683759 | 0.80 | EPHX1 (0.39) | EPHX1HTTACHEMMP2MEN1 | |
| SCHEMBL11676828 | 0.78 | EPHX1 (0.52) | EPHX1HTTACHEMMP2KMT2A | |
| SCHEMBL21132349 | 0.76 | NOS3 (0.50) | EPHX1HTTACHEMMP2MEN1 | |
| Bromide SCHEMBL11808166 | 0.76 | BLM (0.39) | EPHX1HTTACHEMMP2MEN1 | |
| Iodide SCHEMBL1179447 | 0.75 | — | — |
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-4977189-A | Anxiolytic agents, cognition activators | AMERICAN CYANAMID COMPANY (US) | 1990-12-11 | — | — | US | disclosed |
| US-4056527-A | HERBICIDE | BAYER AKTIENGESELLSCHAFT (DT) | 1977-11-01 | — | — | US | disclosed |