Iodide

Iodide

SCHEMBL1301964

C=C(C)C(=O)OC(CCC)N(C)C.I

nearest known ligand 0.39

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 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 3/20 0.37
THRB P10828 1/20 0.34

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
SCHEMBL499776 0.98 ALDH1A1 (0.40) ALDH1A1TSHRTHRB
Bromide SCHEMBL1302282 0.96 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
Fluoride SCHEMBL1302502 0.96 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
Hydrochloric Acid SCHEMBL1302156 0.96 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL500186 0.88 TSHR (0.43) ALDH1A1TSHRTHRB
SCHEMBL5053972 0.86 TSHR (0.46) TSHR
Iodide SCHEMBL1302850 0.85 TSHR (0.38) ALDH1A1TSHRTHRB
SCHEMBL15554493 0.85 THRB (0.31) ALDH1A1TSHRTHRB
SCHEMBL499761 0.85 TSHR (0.49) TSHR
SCHEMBL11785301 0.85 TSHR (0.49) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2010083075-A1 ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-07-22 WO disclosed