Iodide

Iodide

SCHEMBL9575884

CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)CCC[n+]1ccccc1)OC(=O)OC.[I-]

nearest known ligand 0.56

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 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.45
GMNN O75496 1/20 0.44
USP2 O75604 1/20 0.44
PTAFR P25105 1/20 0.44
MTOR P42345 1/20 0.44
BLM P54132 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44

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 SCHEMBL9575875 1.00 LMNA (0.45) LMNAALDH1A1GMNNUSP2PTAFR
SCHEMBL10507788 0.99 LMNA (0.46) LMNAALDH1A1GMNNUSP2PTAFR
SCHEMBL10508071 0.99 LMNA (0.46) LMNAALDH1A1GMNNUSP2PTAFR
SCHEMBL10509122 0.99 LMNA (0.46) LMNAALDH1A1GMNNUSP2PTAFR
Hydrochloric Acid SCHEMBL9575891 0.98 LMNA (0.45) LMNAALDH1A1GMNNUSP2PTAFR
Hydrochloric Acid SCHEMBL9575899 0.98 LMNA (0.45) LMNAALDH1A1GMNNUSP2PTAFR
Hydrochloric Acid SCHEMBL9575966 0.98 LMNA (0.45) LMNAALDH1A1GMNNUSP2PTAFR
Hydrochloric Acid SCHEMBL9575835 0.90 GMNN (0.52) LMNAGMNNUSP2PTAFRMTOR
Iodide SCHEMBL9575802 0.87 LMNA (0.59) LMNAALDH1A1GMNNUSP2PTAFR
Iodide SCHEMBL9575698 0.87 LMNA (0.59) LMNAALDH1A1GMNNUSP2PTAFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4731373-A BLOOD PLATELET ACTIVATING FACTOR HOFFMAN-LA ROCHE INC. (US) 1988-03-15 US claimed
US-5187293-A Blood platelet activating factor inhibitors HOFFMANN-LA ROCHE INC. (US) 1993-02-16 US disclosed
US-4731373-A BLOOD PLATELET ACTIVATING FACTOR HOFFMAN-LA ROCHE INC. (US) 1988-03-15 US disclosed