Iodide

Iodide

SCHEMBL11901430

CN1C=CN(c2cccc3oc4ccccc4c23)C1.I

nearest known ligand 0.36

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
MAOA P21397 7/20 0.34
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 3/20 0.33
MAPT P10636 3/20 0.33
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GLA P06280 2/20 0.33
CYP3A4 P08684 1/20 0.33
PGAM1 P18669 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
PRKDC P78527 1/20 0.33
CDC14B O60729 1/20 0.33
CDC14A Q9UNH5 1/20 0.33
GAA P10253 2/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
CHRNA7 P36544 1/20 0.30
KCNH2 Q12809 1/20 0.30

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 SCHEMBL27085288 0.84 ALOX5 (0.38) MAOAALDH1A1KDM4EMAPTHSD17B10
SCHEMBL12349444 0.82 ALOX5 (0.38) MAOAALDH1A1KDM4EMAPTHSD17B10
SCHEMBL26012060 0.78 TDP1 (0.35) MAOAALDH1A1HPGDMAPTHSD17B10
SCHEMBL26026421 0.75 PRKDC (0.36) ALDH1A1KDM4EHPGDMAPTCYP3A4
SCHEMBL19389196 0.73 CHRNA7 (0.43) MAOAALDH1A1KDM4EHPGDMAPT
Bromide SCHEMBL28205273 0.73 HSD17B10 (0.41) ALDH1A1KDM4EHPGDMAPTHSD17B10
SCHEMBL31678716 0.72 GPR3 (0.36) ALDH1A1KDM4EHPGDMAPTCYP3A4
SCHEMBL29814504 0.72 GPR3 (0.36) ALDH1A1KDM4EHPGDMAPTCYP3A4
SCHEMBL25635217 0.71 PRKDC (0.34) ALDH1A1KDM4EHPGDMAPTPRKDC
SCHEMBL26248556 0.71 PRKDC (0.37) PRKDC

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-9108998-B2 Dinuclear platinum-carbene complexes and the use thereof in OLEDs BASF SE (DE) 2015-08-18 US disclosed
US-20120199823-A1 DINUCLEAR PLATINUM-CARBENE COMPLEXES AND THE USE THEREOF IN OLEDS BASF SE (DE) 2012-08-09 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-20120199823-A1 DINUCLEAR PLATINUM-CARBENE COMPLEXES AND THE USE THEREOF IN OLEDS OCIAD1, OCIAD2, OXER1 MAOA 2667/4885ALDH1A1 2775/4885KDM4E 4868/4885

“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.