Iodide

Iodide

SCHEMBL28986961

CN1C(=O)Cc2ccc3ccccc3c21.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 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ANPEP P15144 1/20 0.39
PAX8 Q06710 1/20 0.36
METAP2 P50579 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 3/20 0.36
HTR1A P08908 2/20 0.36
HTR7 P34969 2/20 0.36
GAA P10253 2/20 0.36
GLA P06280 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
NOTUM Q6P988 1/20 0.36
CYP2A6 P11509 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL6739894 0.83 CYP11B1 (0.44) KDM4EMAPTMEN1KMT2AANPEP
SCHEMBL6784220 0.83 BRPF1 (0.37) KDM4EMAPTMEN1KMT2AANPEP
SCHEMBL12776571 0.77 CYP2A6 (0.42) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL1408720 0.75 HPGD (0.51) KDM4EMEN1KMT2AANPEPALDH1A1
SCHEMBL6740645 0.72 ANPEP (0.38) KDM4EMAPTMEN1KMT2AANPEP
SCHEMBL6788345 0.72 MAPT (0.36) KDM4EMAPTMEN1KMT2APAX8
SCHEMBL12776616 0.70 KDM4E (0.39) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL13239543 0.69 CYP1A2 (0.52) MAPTMEN1KMT2AALDH1A1HSD17B10
SCHEMBL2604372 0.69 MAPT (0.41) KDM4EMAPTMEN1KMT2APAX8
SCHEMBL30404908 0.68 KMT2A (0.46) MAPTMEN1KMT2AALDH1A1HTR1A

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
CN-114507212-B Benzoindoline-dihydroquinolinone derivative fluorescent probe and preparation method and application thereof 河南理工大学 2023-03-24 CN disclosed