Iodide

Iodide

SCHEMBL28520797

CN1CCC(O)CC1.CN1CCC(O)CC1.I.I

nearest known ligand 0.43

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
GPR119 Q8TDV5 1/20 0.42
NCF1 P14598 1/20 0.42
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.37
QDPR P09417 1/20 0.34
SPHK1 Q9NYA1 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KCNA3 P22001 1/20 0.32
CYP1A2 P05177 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL3359855 0.97
SCHEMBL4556181 0.97 GPR119 (0.43) GPR119NCF1LMNACYP2C9TSHR
SCHEMBL7928 0.97
Methane SCHEMBL2671466 0.94
Hydrochloric Acid SCHEMBL6489107 0.94
Ethane SCHEMBL27516222 0.94 GPR119 (0.42) GPR119NCF1LMNACYP2C9TSHR
Hno SCHEMBL27257994 0.88 GPR119 (0.39) GPR119NCF1LMNACYP2C9TSHR
SCHEMBL23107536 0.86
SCHEMBL19045196 0.86
SCHEMBL2487331 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112218845-A FOXM1 inhibitor compositions and methods of use thereof 伊利诺伊大学理事会 2021-01-12 CN claimed
CN-112218845-A FOXM1 inhibitor compositions and methods of use thereof 伊利诺伊大学理事会 2021-01-12 CN disclosed