Iodide

Iodide

SCHEMBL7758712

CCCCCCCCCCN(CCCCCCCCCC)c1cc[n+](C)c(C=Cc2ccccc2)c1.[I-]

nearest known ligand 0.47

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
CHRM1 known ✓ P11229 1/20 0.37
CHRM3 known ✓ P20309 1/20 0.37
ACHE known ✓ P22303 1/20 0.36
APP P05067 4/20 0.47
KDM4A O75164 4/20 0.45
KDM2A Q9Y2K7 4/20 0.45
CHAT P28329 3/20 0.41
INSR P06213 1/20 0.40
RAB9A P51151 3/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
GFER P55789 1/20 0.38
PABPC1 P11940 1/20 0.38
EIF4H Q15056 1/20 0.38
GAA P10253 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37

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
SCHEMBL8631682 0.99 APP (0.46) APPKDM4AKDM2ACHATINSR
SCHEMBL6711964 0.83 RAB9A (0.49) APPCHATRAB9AMEN1NPC1
SCHEMBL28387158 0.77 INSR (0.55) KDM4AKDM2AINSRCHRM2CHRM4
SCHEMBL9822952 0.77 INSR (0.55) KDM4AKDM2AINSRCHRM2CHRM4
Iodide SCHEMBL8702276 0.76 KDM4A (0.53) APPKDM4AKDM2AINSRRAB9A
SCHEMBL5712602 0.75 INSR (0.53) APPKDM4AKDM2AINSRCHRM2
SCHEMBL5493740 0.75 INSR (0.53) APPKDM4AKDM2AINSRCHRM2
Iodide SCHEMBL3954410 0.75 KDM4A (0.56) APPKDM4AKDM2ACHATINSR
Iodide SCHEMBL187217 0.75 KDM4A (0.56) APPKDM4AKDM2ACHATINSR
Iodide SCHEMBL554665 0.75 KDM4A (0.56) APPKDM4AKDM2ACHATINSR

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
EP-1080110-A2 USE OF ACTIVATED T CELLS, NERVOUS SYSTEM-SPECIFIC ANTIGENS FOR TREATING DISORDERS OF THE NEVROUS SYSTEM YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2001-03-07 EP disclosed
WO-1999060021-A2 USE OF ACTIVATED T CELLS, NERVOUS SYSTEM-SPECIFIC ANTIGENS FOR TREATING DISORDERS OF THE NEVROUS SYSTEM YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1999-11-25 WO disclosed