Sugi Predict

Sugi Predict / Compounds / Iodide

Iodide

Iodide

SCHEMBL9307046

CCCCCCCCCCCCOc1ccc(N(Cc2ccc[n+](CC)c2)C(C)=O)c(C)c1.[I-]

nearest known ligand 0.51

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 5)

geneUniProtsupporting neighboursconfidence
▸ GGPS1 O95749 3/20 0.41
▸ THRA P10827 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ FDPS P14324 1/20 0.39
▸ PTPN11 Q06124 1/20 0.39

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 SCHEMBL9305527 0.90 THRA (0.42) THRATHRBPTPN11
Iodide SCHEMBL9306808 0.88 THRA (0.43) THRATHRBPTPN11
Iodide SCHEMBL9306678 0.83 THRA (0.44) THRATHRBPTPN11
Iodide SCHEMBL9308037 0.80 — —
Iodide SCHEMBL9309124 0.80 — —
Iodide SCHEMBL9307609 0.78 POLB (0.41) —
Iodide SCHEMBL9307964 0.77 — —
Iodide SCHEMBL9307912 0.77 THRA (0.42) THRATHRB
Iodide SCHEMBL9305575 0.77 THRA (0.42) THRATHRB
Iodide SCHEMBL9309473 0.77 MAOB (0.39) —

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
US-5328921-A Antagonist of platelet activating factor AMERICAN CYANAMID COMPANY (US) 1994-07-12 — — US disclosed