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 | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 6/20 | 0.55 |
| ▸ | ERN1 | O75460 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ALPL | P05186 | 1/20 | 0.41 |
| ▸ | ALPI | P09923 | 1/20 | 0.41 |
| ▸ | ALPG | P10696 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL4345964 | 0.87 | CA2 (0.74) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL4345961 | 0.87 | CA2 (0.74) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL19382909 | 0.82 | CA2 (0.68) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL14354169 | 0.82 | CA2 (0.68) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL14354170 | 0.82 | CA2 (0.68) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL24201091 | 0.82 | CA2 (0.68) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL24440799 | 0.80 | CA2 (0.65) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL11852363 | 0.75 | ERN1 (0.65) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL18719806 | 0.75 | ERN1 (0.65) | CA2ALDH1A1KMT2AKDM4ECA1 | |
| SCHEMBL17743542 | 0.74 | CA2 (0.64) | CA2ALDH1A1KMT2AKDM4ECA1 |
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-5071965-A | NOVEL TC-99M COMPLEXES | MALLINCKRODT MEDICAL, INC. (US) | 1991-12-10 | — | — | US | disclosed |