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 | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | PTGIR | P43119 | 2/20 | 0.38 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 7/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 7/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 7/20 | 0.35 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.35 |
| ▸ | TOP2A | P11388 | 2/20 | 0.33 |
| ▸ | TOP2B | Q02880 | 2/20 | 0.33 |
| ▸ | CFB | P00751 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8781427 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL11687689 | 0.96 | NOS3 (0.41) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Hydrochloric Acid SCHEMBL11685765 | 0.96 | NOS3 (0.41) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Bromide SCHEMBL11701954 | 0.94 | NOS3 (0.40) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Bromide SCHEMBL11702629 | 0.94 | NOS3 (0.40) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Bromide SCHEMBL11701958 | 0.94 | NOS3 (0.40) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Bromide SCHEMBL11700693 | 0.94 | NOS3 (0.40) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Bromide SCHEMBL11702626 | 0.94 | NOS3 (0.40) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Bromide SCHEMBL11700688 | 0.94 | NOS3 (0.40) | NOS3NOS1NOS2PTGIRAPOBEC3A | |
| Bromide SCHEMBL11702497 | 0.94 | NOS3 (0.40) | NOS3NOS1NOS2PTGIRAPOBEC3A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0027877-B1 | 5,8-DIHYDROXY-1,4-BIS(GUANIDINYL-AMINO)ANTHRAQUINONES | AMERICAN CYANAMID COMPANY (US) | 1983-07-13 | — | — | EP | disclosed |
| US-4333875-A | CHELATING AGENTS AND ANTITUMOR AGENTS | AMERICAN CYANAMID COMPANY (US) | 1982-06-08 | — | — | US | disclosed |
| US-4275010-A | ANTITUMOR, CHELATION | AMERICAN CYANAMID COMPANY (US) | 1981-06-23 | — | — | US | disclosed |
| US-4258181-A | BACTERICIDES, AMTITUMOR AGENTS, ANTICARCINOGENIC AGENTS | AMERICAN CYANAMID COMPANY (US) | 1981-03-24 | — | — | US | disclosed |
| EP-0008854-A1 | Pentadienone hydrazone, and its use as insecticidal agent | AMERICAN CYANAMID COMPANY (US) | 1980-03-19 | — | — | EP | disclosed |
| US-4191768-A | Pentadienone hydrazones, method for preparing the same, and insecticidal use thereof | AMERICAN CYANAMID COMPANY (US) | 1980-03-04 | — | — | US | disclosed |
| US-3931152-A | ANTITUBERCULAR | AMERICAN CYANAMID COMPANY (US) | 1976-01-06 | — | — | US | disclosed |