Iodide

Iodide

SCHEMBL4886944

C[n+]1ccc(/C=C/c2ccc3[nH]ccc3c2)c2ccccc21.[I-]

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

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)

geneUniProtsupporting neighboursconfidence
CHAT P28329 4/20 0.58
RAD52 P43351 3/20 0.56
APP P05067 4/20 0.55
HTT P42858 5/20 0.51
NPSR1 Q6W5P4 5/20 0.51
MAPT P10636 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
PKM P14618 3/20 0.51
MAPK1 P28482 3/20 0.51
MEN1 O00255 6/20 0.50
NPC1 O15118 6/20 0.50
RAB9A P51151 6/20 0.50
KMT2A Q03164 6/20 0.50
POLB P06746 4/20 0.50
NSD2 O96028 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 3/20 0.42
LMNA P02545 2/20 0.42
RECQL P46063 2/20 0.42
ALDH1A1 P00352 2/20 0.42

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.

Compoundsimilaritytop predictedshared targets
Iodide SCHEMBL4886952 1.00 CHAT (0.58) CHATRAD52APPHTTNPSR1
Iodide SCHEMBL4883348 0.86 MEN1 (0.60) CHATRAD52APPHTTNPSR1
Iodide SCHEMBL4883351 0.86 MEN1 (0.60) CHATRAD52APPHTTNPSR1
SCHEMBL15911974 0.79 CHAT (0.62) CHATRAD52APPHTTNPSR1
Iodide SCHEMBL6858541 0.77 CHAT (0.67) CHATRAD52APPHTTNPSR1
Iodide SCHEMBL6858540 0.77 CHAT (0.67) CHATRAD52APPHTTNPSR1
SCHEMBL12686413 0.75 HTT (0.70) CHATRAD52APPHTTNPSR1
SCHEMBL12866151 0.75 CHAT (0.67) CHATRAD52APPHTTNPSR1
Iodide SCHEMBL6559481 0.74 CHAT (0.62) CHATRAD52APPHTTNPSR1
SCHEMBL13766059 0.74 CHAT (0.79) CHATRAD52APPHTTNPSR1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080113944-A1 Novel Indole Derivatives NOVO NORDISK A/S (DK) 2008-05-15 US claimed
US-20080113944-A1 Novel Indole Derivatives NOVO NORDISK A/S (DK) 2008-05-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080113944-A1 Novel Indole Derivatives GPR119, FABP4, MC4R CHAT 1267/4885RAD52 3681/4885APP 4818/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.