Iodide

Iodide

SCHEMBL8724138

CCCCCCCCCCCCCCCCCC[n+]1ccc(C=Cc2ccc(N(CCCCCC)CCCCCC)cc2)cc1.[I-]

nearest known ligand 0.74

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 2/20 0.67
CHRM3 known ✓ P20309 2/20 0.67
KDM4A O75164 4/20 0.74
KDM2A Q9Y2K7 4/20 0.74
CHRM2 P08172 2/20 0.67
CHRM4 P08173 2/20 0.67
CHRM5 P08912 2/20 0.67
INSR P06213 3/20 0.56
HTT P42858 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
RAB9A P51151 1/20 0.50
CHAT P28329 1/20 0.49
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
APAF1 O14727 1/20 0.48
HSP90AA1 P07900 1/20 0.48

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 SCHEMBL8722937 1.00 KDM4A (0.74) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL8727750 0.99 KDM4A (0.74) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL8727754 0.99 KDM4A (0.74) KDM4AKDM2ACHRM2CHRM4CHRM5
Bromide SCHEMBL10845620 0.97 KDM4A (0.72) KDM4AKDM2ACHRM2CHRM4CHRM5
Bromide SCHEMBL10845617 0.97 KDM4A (0.72) KDM4AKDM2ACHRM2CHRM4CHRM5
Iodide SCHEMBL8723083 0.97 KDM4A (0.74) KDM4AKDM2ACHRM2CHRM4CHRM5
Iodide SCHEMBL8723080 0.97 KDM4A (0.74) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL10103994 0.96 KDM4A (0.74) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL10340878 0.96 KDM4A (0.69) KDM4AKDM2ACHRM2CHRM4CHRM5
SCHEMBL10340827 0.96 KDM4A (0.69) KDM4AKDM2ACHRM2CHRM4CHRM5

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0713585-B1 Z-TYPE FILMS FOR SECOND HARMONIC GENERATION BRITISH TECH GROUP (GB) 1998-09-30 EP claimed
US-5786089-A Z-type films for second harmonic generation BRITISH TECHNOLOGY GROUP LTD. (GB) 1998-07-28 US claimed
EP-0713585-B1 Z-TYPE FILMS FOR SECOND HARMONIC GENERATION BRITISH TECH GROUP (GB) 1998-09-30 EP disclosed
US-5786089-A Z-type films for second harmonic generation BRITISH TECHNOLOGY GROUP LTD. (GB) 1998-07-28 US disclosed