Iodide

Iodide

SCHEMBL6832071

I.c1ccc2c(c1)ccc1[nH]ccc12

nearest known ligand 0.52

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
ALDH1A1 P00352 4/20 0.52
HSD17B10 Q99714 4/20 0.52
CYP2A6 P11509 1/20 0.52
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
AHR P35869 2/20 0.48
TRPA1 O75762 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
ITGB2 P05107 1/20 0.48
ICAM1 P05362 1/20 0.48
ITGAL P20701 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
ADK P55263 1/20 0.48
HPRT1 P00492 3/20 0.48
PARP1 P09874 1/20 0.47
KDM4E B2RXH2 2/20 0.46
RAB9A P51151 2/20 0.46
SIRT2 Q8IXJ6 1/20 0.46

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
SCHEMBL280428 0.98 ALDH1A1 (0.55) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL29628855 0.98 ALDH1A1 (0.55) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Water SCHEMBL3636507 0.96 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Hydrochloric Acid SCHEMBL7799642 0.96 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Bromide SCHEMBL7761036 0.96 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Water SCHEMBL10356869 0.94 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Water SCHEMBL10356864 0.94 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL29444130 0.94 HPRT1 (0.58) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL2126075 0.94 HPRT1 (0.58) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL30713692 0.94 HPRT1 (0.58) ALDH1A1HSD17B10CYP2A6TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2627360-A1 SILICA NANOPARTICLES DOPED WITH MULTIPLE DYES FEATURING HIGHLY EFFICIENT ENERGY TRANSFER AND TUNABLE STOKES-SHIFT Alma Mater Studiorum -Universita' di Bologna (IT) 2013-08-21 EP claimed
WO-2012049657-A1 SILICA NANOPARTICLES DOPED WITH MULTIPLE DYES FEATURING HIGHLY EFFICIENT ENERGY TRANSFER AND TUNABLE STOKES-SHIFT ALMA MATER STUDIORUM UNIVERSITÀ DI BOLOGNA (IT) 2012-04-19 WO claimed
WO-2024148293-A1 CHARGED PI-CONJUGATED MOLECULES FOR THE TREATMENT OF MICROBIAL INFECTIONS WILLIAM MARSH RICE UNIVERSITY (US) 2024-07-11 WO disclosed
WO-2019217583-A1 NEAR-INFRARED HARVESTING TRANSPARENT LUMINESCENT SOLAR CONCENTRATORS WITH ENGINEERED STOKES SHIFT BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2019-11-14 WO disclosed
US-6740128-B2 BLEND CONTAINING ENAMINE AND ALKALINE MIXTURE OF ALDEHYDE AND PRIMARY AMINE WELLA AKTIENGESELLSCHAFT (DE) 2004-05-25 US disclosed