Iodide

Iodide

SCHEMBL1255401

C=CC(=O)OCC(O)C[N+](C)(C)C.[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
CHRM1 known ✓ P11229 2/20 0.34
CHRM3 known ✓ P20309 1/20 0.33
TSHR P16473 9/20 0.57
HPGD P15428 2/20 0.41
ALDH1A1 P00352 5/20 0.41
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
CYP3A4 P08684 3/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 4/20 0.39
SLC22A16 Q86VW1 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
MAPK1 P28482 1/20 0.37
THRB P10828 2/20 0.35
CHRM2 P08172 2/20 0.34
CHRM4 P08173 2/20 0.34
TBXA2R P21731 1/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 2/20 0.33
CHRM5 P08912 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
SCHEMBL5672906 0.98 TSHR (0.59) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL434986 0.96 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Fluoride Ion SCHEMBL1252819 0.96 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL1254203 0.96 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL28204650 0.94 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL28204649 0.93 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9505637 0.90 TSHR (0.50) TSHRHPGDALDH1A1TP53HIF1A
Iodide SCHEMBL1254969 0.84 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL95157 0.83 TSHR (0.64) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11101174 0.81 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461237-B2 Gel composition, method of preparing the same, and impact resistant absorbing material using the same 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-06-11 US disclosed
EP-2387866-A1 ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION 3M Innovative Properties Company (US) 2011-11-23 EP disclosed
US-20110268950-A1 Electromagnetic Wave Shielding Gel-Like Composition 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-11-03 US disclosed
US-8038066-B2 Laser scanner with deformable lens HAND HELD PRODUCTS, INC. (US) 2011-10-18 US disclosed
US-20110097585-A1 GEL COMPOSITION, METHOD OF PREPARING THE SAME, AND IMPACT RESISTANT ABSORBING MATERIAL USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY 2011-04-28 US disclosed
EP-2285900-A2 GEL COMPOSITION, METHOD FOR PREPARING THE SAME, AND IMPACT RESISTANT ABSORBING MATERIAL USING THE SAME 3M Innovative Properties Company (US) 2011-02-23 EP disclosed
WO-2010083075-A1 ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-07-22 WO disclosed
WO-2009134694-A2 GEL COMPOSITION, METHOD FOR PREPARING THE SAME, AND IMPACT RESISTANT ABSORBING MATERIAL USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-11-05 WO disclosed