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 | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | BBOX1 | O75936 | 2/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL7768009 | 0.97 | KDM4E (0.60) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| SCHEMBL14734616 | 0.81 | BBOX1 (0.50) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| Bromide SCHEMBL14721646 | 0.79 | BBOX1 (0.48) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| SCHEMBL9936384 | 0.78 | KDM4E (0.55) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| SCHEMBL4546786 | 0.77 | LMNA (0.50) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| SCHEMBL4546781 | 0.77 | LMNA (0.50) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| SCHEMBL14863930 | 0.77 | LMNA (0.50) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| SCHEMBL6767920 | 0.76 | KDM4E (0.59) | KDM4EBBOX1CHRNA7LMNAKMT2A | |
| Iodide SCHEMBL7764342 | 0.75 | KDM4E (0.34) | KDM4ECHRM2CHRM4CHRM5CHRM1 | |
| Bromide SCHEMBL14915227 | 0.75 | LMNA (0.49) | KDM4EBBOX1CHRNA7LMNAKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0700916-B1 | CEPHEM COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ANTIBACTERIAL CONTAINING THE COMPOUND | OTSUKA KAGAKU KK (JP) | 2001-06-20 | — | — | EP | disclosed |
| US-5698544-A | ANTIBOIOTIC AGAINST METHICILLIN RESISTANCE STAPHYLOCOCCUS AUREUS | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1997-12-16 | — | — | US | disclosed |
| EP-0700916-A1 | CEPHEM COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ANTIBACTERIAL CONTAINING THE COMPOUND | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1996-03-13 | — | — | EP | disclosed |