Iodide

Iodide

SCHEMBL11060156

C[N+]1(CC(O)COc2cccc3c2CCC(=O)N3Cc2ccccc2)CCC(c2ccccc2)CC1.[I-]

nearest known ligand 0.45

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 11)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 3/20 0.45
HTR6 P50406 3/20 0.39
KCNH2 Q12809 2/20 0.38
POLB P06746 1/20 0.37
ABCB1 P08183 2/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
EGLN1 Q9GZT9 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
Iodide SCHEMBL11071282 0.90 ABCB1 (0.41) HTR6POLBABCB1ADRB2ADRB1
Iodide SCHEMBL11071830 0.89 SLC18A3 (0.44) SLC18A3KCNH2ABCB1ADRB2ADRB1
SCHEMBL11061136 0.83 KCNH2 (0.56) KCNH2ABCB1ADRB2ADRB1ADRB3
SCHEMBL11729211 0.79 HTR6 (0.48) HTR6POLBABCB1EGLN1
Iodide SCHEMBL11065747 0.78 ADRB1 (0.54) SLC18A3KCNH2ABCB1ADRB2ADRB1
Hydrochloric Acid SCHEMBL11066906 0.76 HTR6 (0.44) SLC18A3HTR6POLB
SCHEMBL11065039 0.74 DRD4 (0.60) ABCB1ADRB2ADRB1ADRB3
SCHEMBL10570390 0.74 MAPT (0.56) KCNH2ABCB1
SCHEMBL11070274 0.73 CHRM1 (0.55) HTR6
Hydrochloric Acid SCHEMBL10570172 0.73 MAPT (0.55) KCNH2ABCB1

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-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed