Iodide

Iodide

SCHEMBL10901409

O=C(O)c1ccc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.[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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
DAO P14920 1/20 0.56
NAPRT Q6XQN6 1/20 0.56
TP53 P04637 1/20 0.55
SRD5A2 P31213 4/20 0.54
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
TRPA1 O75762 1/20 0.48
ALDH1A1 P00352 2/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA12 O43570 1/20 0.46
CA3 P07451 1/20 0.46
TYR P14679 1/20 0.46
DRD1 P21728 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46

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
Tetraphenylphosphonium SCHEMBL2000466 0.83 TSHR (0.58) TSHRDAONAPRTTP53SRD5A2
Hydrochloric Acid SCHEMBL11806139 0.78 MAPT (0.57) ALDH1A1CA12CA9SMN1; SMN2
Tetraphenylphosphonium SCHEMBL21957806 0.77 CA2 (0.62) TSHRDAONAPRTCES2CES1
Terephthalic Acid SCHEMBL4961359 0.77 TSHR (0.93) TSHRDAONAPRTTP53SRD5A2
Terephthalic Acid SCHEMBL21443891 0.77 TSHR (0.92) TSHRDAONAPRTTP53SRD5A2
Tetraphenylphosphonium SCHEMBL158514 0.77 HIF1A (0.47) TSHRALDH1A1CA1CA2CA12
Tetraphenylphosphonium SCHEMBL4388860 0.75 CA2 (0.46) TSHRDAONAPRTCES2CES1
Terephthalic Acid SCHEMBL9250012 0.74 TSHR (0.86) TSHRDAONAPRTTP53SRD5A2
Benzoic Acid SCHEMBL137419 0.74 TSHR (1.00) TSHRDAONAPRTTP53SRD5A2
Benzoic Acid SCHEMBL975929 0.74 TSHR (1.00) TSHRDAONAPRTTP53SRD5A2

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-4585889-A Carbonylation process for the production of monoesters aromatic dicarboxylic acids from phosphonium salts EASTMAN KODAK COMPANY (US) 1986-04-29 US disclosed