Iodide

Iodide

SCHEMBL5146463

CCCCCCn1c(-c2ccccc2)[n+](C)c2ccccc21.[I-]

nearest known ligand 0.46

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
ACHE known ✓ P22303 1/20 0.39
ERAP1 Q9NZ08 1/20 0.46
KDM4E B2RXH2 3/20 0.45
MAPT P10636 3/20 0.45
TLR8 Q9NR97 2/20 0.45
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 1/20 0.41
APAF1 O14727 1/20 0.41
USP2 O75604 1/20 0.41
RAD52 P43351 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 1/20 0.41
GRIN1 Q05586 5/20 0.39
GRIN2A Q12879 5/20 0.39
GRIN2B Q13224 5/20 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
SCHEMBL24566455 0.87 ERAP1 (0.40) ERAP1KDM4EMAPTTLR8LMNA
SCHEMBL29737367 0.84 ERAP1 (0.40) ERAP1KDM4EMAPTTLR8LMNA
Bromide SCHEMBL10607701 0.78 ERAP1 (0.44) ERAP1KDM4EMAPTTLR8LMNA
Iodide SCHEMBL5146457 0.76 PTPN1 (0.47) ERAP1KDM4EMAPTLMNAHTT
SCHEMBL13173879 0.75 ERAP1 (0.73) ERAP1KDM4EMAPTLMNAHTT
SCHEMBL30145235 0.75 ERAP1 (0.73) ERAP1KDM4EMAPTLMNAHTT
Iodide SCHEMBL5143883 0.75 ATM (0.47) KDM4ETLR8LMNASMN1; SMN2TDP1
SCHEMBL29073229 0.75 ERAP1 (0.52) ERAP1KDM4EMAPTLMNAHTT
SCHEMBL29737321 0.75 ERAP1 (0.52) ERAP1KDM4EMAPTLMNAHTT
SCHEMBL29549686 0.74 PTPN1 (0.45) ERAP1KDM4EMAPTLMNAHTT

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
US-7273953-B2 Process for producing arylamine FUJIFILM FINECHEMICALS CO., LTD. (JP) 2007-09-25 US disclosed
US-20060069287-A1 Process for producing arylamine FUJIFILM FINECHEMICALS CO., LTD. (JP) 2006-03-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060069287-A1 Process for producing arylamine TYR, AADAC, AOC2 ACHE 1678/4885ERAP1 3129/4885KDM4E 1302/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.