Iodide

Iodide

SCHEMBL7024152

CCN(CC)C(=Cc1ccccc1)c1cccc[n+]1CC.[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
ALDH1A1 P00352 3/20 0.38
NPC1 O15118 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
STAT3 P40763 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 2/20 0.33
KDM1A O60341 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
NR1I2 O75469 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TSHR P16473 1/20 0.30
AKR1C3 P42330 1/20 0.30
CHAT P28329 1/20 0.30

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 SCHEMBL5229857 0.87 MEN1 (0.42) ALDH1A1NPC1MEN1KMT2AMAPT
SCHEMBL17911707 0.85 MEN1 (0.40) ALDH1A1NPC1MEN1KMT2AMAPT
SCHEMBL12411252 0.74 NPC1 (0.49) ALDH1A1NPC1MEN1KMT2AMAPT
SCHEMBL11206642 0.74 NPC1 (0.49) ALDH1A1NPC1MEN1KMT2AMAPT
Iodide SCHEMBL8745570 0.74 MEN1 (0.33) ALDH1A1NPC1MEN1KMT2AMAPT
SCHEMBL8745599 0.72 MEN1 (0.32) ALDH1A1NPC1MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL11314920 0.71 MEN1 (0.31) ALDH1A1NPC1MEN1KMT2AMAPT
Iodide SCHEMBL8072633 0.69 MEN1 (0.35) ALDH1A1NPC1MEN1KMT2AMAPT
SCHEMBL9804059 0.68 CYP19A1 (0.47) ALDH1A1NPC1MEN1KMT2AMAPT
SCHEMBL5709306 0.68 ALDH1A1 (0.47) ALDH1A1NPC1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672953-B1 Photosensitive recording material, photosensitive recording medium, and process for producing hologram using this photosensitive recording medium TOPPAN PRINTING CO LTD (JP) 2003-01-15 EP disclosed
US-6045953-A COMPRISES A SUBSTRATE, A PHOTOSENSITIVE LAYER FORMED ON THE SUBSTRATE BY COATING A PHOTOSENSITIVE SOLUTION CONTAINING AN ALICYCLIC, SOLVENT SOLUBLE, CATIONIC POLYMERIZABLE EPOXY RESIN AND AN ACRYLATE POLYMER TOPPAN PRINTING CO., LTD. (JP) 2000-04-04 US disclosed
EP-0697631-B1 Photosensitive recording material, photosensitive recording medium, and process for producing hologram using this photosensitive recording medium TOPPAN PRINTING CO LTD (JP) 1998-06-10 EP disclosed
US-5698345-A CATIONIC POLYMERIZATION OF THERMOSETTING EPOXY OLIGOMER TOPPAN PRINTING CO., LTD. (JP) 1997-12-16 US disclosed
EP-0697631-A1 Photosensitive recording material, photosensitive recording medium, and process for producing hologram using this photosensitive recording medium Toppan Printing Co., Ltd. (JP) 1996-02-21 EP disclosed
EP-0672953-A2 Photosensitive recording material, photosensitive recording medium, and process for producing hologram using this photosensitive recording medium Toppan Printing Co., Ltd. (JP) 1995-09-20 EP disclosed