Iodide

Iodide

SCHEMBL7109823

Cc1nc2ccccc2o1.I

nearest known ligand 0.57

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
MAPT P10636 5/20 0.57
GAA P10253 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
NPC1 O15118 6/20 0.52
RAB9A P51151 6/20 0.52
ELANE P08246 3/20 0.52
PSMB8 P28062 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
PKM P14618 3/20 0.47
TP53 P04637 3/20 0.47
LMNA P02545 1/20 0.47
ALDH1A1 P00352 4/20 0.46
HPGD P15428 3/20 0.46
KDM4E B2RXH2 2/20 0.46
USP2 O75604 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HCRTR1 O43613 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
SCHEMBL17312298 0.98 MAPT (0.59) MAPTGAAL3MBTL1NPC1RAB9A
SCHEMBL129661 0.98 MAPT (0.59) MAPTGAAL3MBTL1NPC1RAB9A
Hydrochloric Acid SCHEMBL5983442 0.95 MAPT (0.57) MAPTGAAL3MBTL1NPC1RAB9A
SCHEMBL10670489 0.95 MAPT (0.57) MAPTGAAL3MBTL1NPC1RAB9A
Naphthalene SCHEMBL11144924 0.93 MAPT (0.55) MAPTGAAL3MBTL1NPC1RAB9A
SCHEMBL11769878 0.88 MAPT (0.50) MAPTGAAL3MBTL1NPC1RAB9A
Formic Acid SCHEMBL28267340 0.86 MAPT (0.53) MAPTGAAL3MBTL1NPC1RAB9A
SCHEMBL11036875 0.83 MAPT (0.50) MAPTGAAL3MBTL1NPC1RAB9A
SCHEMBL31043101 0.81 GAA (0.51) MAPTGAAL3MBTL1NPC1RAB9A
SCHEMBL31043074 0.81 L3MBTL1 (0.47) MAPTGAAL3MBTL1NPC1RAB9A

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
WO-2003087052-A2 DYES AND FLUORESCENT COMPOUNDS TERPETSCHNIG EWALD A (US) 2003-10-23 WO disclosed