Iodide

Iodide

SCHEMBL7743808

CCCCCCCCCCCCCCCCCCN1C(C)=NC(C)=CC1C.I

nearest known ligand 0.38

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
GBA1 P04062 1/20 0.38
TLR8 Q9NR97 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
APOBEC3A P31941 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
NOD2 Q9HC29 1/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SLC9A1 P19634 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 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.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL9381770 0.66 KMT2A (0.32) GBA1KMT2A
Bromide SCHEMBL460851 0.66 ALDH1A1 (0.47) GBA1SMN1; SMN2NPC1LMNAHTT
SCHEMBL23702993 0.62 PTGS1 (0.36) GBA1SMN1; SMN2NPC1LMNAAPOBEC3A
SCHEMBL18373557 0.61 PTGS1 (0.39) GBA1SMN1; SMN2NPC1LMNAAPOBEC3A
SCHEMBL3306424 0.61 GBA1 (0.41) GBA1SMN1; SMN2NPC1LMNAHTT
SCHEMBL28987920 0.61 GBA1 (0.41) GBA1SMN1; SMN2NPC1LMNAHTT
SCHEMBL23163261 0.60 EBP (0.47) SMN1; SMN2NPC1LMNAAPOBEC3AHTT
SCHEMBL25387249 0.59 TDP1 (0.40) LMNAKMT2APOLBTP53TDP1
Nonane SCHEMBL8084281 0.54 TSHR (0.73) SMN1; SMN2LMNAHTTMAPTKMT2A
Benzene SCHEMBL7777324 0.54 TSHR (0.73) SMN1; SMN2LMNAHTTMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6184180-B1 COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE MITSUBISHI PAPER MILLS LIMITED (JP) 2001-02-06 US disclosed