Iodide

Iodide

SCHEMBL1485891

O=C(C[n+]1ccccc1)c1ccc(Br)cc1.[I-]

nearest known ligand 0.70

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
PABPC1 P11940 2/20 0.70
KDM4E B2RXH2 1/20 0.65
MAPT P10636 2/20 0.61
HTT P42858 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
ALDH1A1 P00352 3/20 0.57
RECQL P46063 1/20 0.57
KMT2A Q03164 5/20 0.54
MEN1 O00255 3/20 0.53
RAB9A P51151 1/20 0.51
AHR P35869 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GSK3B P49841 2/20 0.50
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.48
ATM Q13315 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47

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
SCHEMBL4401836 0.98 PABPC1 (0.67) PABPC1KDM4EMAPTHTTSMN1; SMN2
Bromide SCHEMBL2691176 0.96 KDM4E (0.70) PABPC1KDM4EMAPTHTTSMN1; SMN2
SCHEMBL765905 0.83 KDM4E (0.76) PABPC1KDM4EMAPTHTTSMN1; SMN2
Iodide SCHEMBL20704647 0.82 PABPC1 (0.70) PABPC1KDM4EMAPTHTTSMN1; SMN2
Bromide SCHEMBL2695097 0.82 RAB9A (0.70) PABPC1KDM4EMAPTHTTSMN1; SMN2
Iodide SCHEMBL28984856 0.81 PABPC1 (0.55) PABPC1KDM4EMAPTHTTSMN1; SMN2
SCHEMBL28520864 0.81 KDM4E (0.73) PABPC1KDM4EMAPTHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL2527501 0.81 KMT2A (0.73) PABPC1KDM4EMAPTHTTSMN1; SMN2
Ammonia Solution, Strong SCHEMBL28760030 0.81 KDM4E (0.73) PABPC1KDM4EMAPTHTTSMN1; SMN2
Bromide SCHEMBL698678 0.81 KDM4E (0.79) PABPC1KDM4EMAPTHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104617229-B Organic electroluminescence device 保土谷化学工业株式会社 2017-09-08 CN disclosed
EP-2128159-B1 COMPOUND WHEREIN SUBSTITUTED BIPYRIDYL GROUP IS CONNECTED WITH PYRIDOINDOLE RING STRUCTURE THROUGH PHENYLENE GROUP, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2017-08-16 EP disclosed
US-9525140-B2 Arylamine compound useful in an organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2016-12-20 US disclosed
EP-2299509-B1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO LTD (JP) 2016-06-29 EP disclosed
CN-104617229-A Organic electroluminescent device HODOGAYA CHEMICAL CO LTD 2015-05-13 CN disclosed
US-8771841-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2014-07-08 US disclosed
US-20140039221-A1 ARYLAMINE COMPOUND USEFUL IN AN ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2014-02-06 US disclosed
CN-103553935-A Organic electroluminescent device HODOGAYA CHEMICAL CO LTD 2014-02-05 CN disclosed
EP-2677562-A2 Arylamines for organic electroluminescent devices Hodogaya Chemical Co., Ltd. (JP) 2013-12-25 EP disclosed
EP-2383816-B1 Organic electroluminescent device HODOGAYA CHEMICAL CO LTD (JP) 2013-03-27 EP disclosed
US-8252431-B2 Compound wherein substituted bipyridyl group is connected with pyridoindole ring structure through phenylene group, and organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2012-08-28 US disclosed
EP-2383816-A1 Organic electroluminescent device Hodogaya Chemical Co., Ltd. (JP) 2011-11-02 EP disclosed
CN-102027613-A Organic electroluminescent device HODOGAYA CHEMICAL CO LTD 2011-04-20 CN disclosed
US-20110073852-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2011-03-31 US disclosed
EP-2299509-A1 ORGANIC ELECTROLUMINESCENT DEVICE Hodogaya Chemical Co., Ltd. (JP) 2011-03-23 EP disclosed
US-20100123388-A1 COMPOUND WHEREIN SUBSTITUTED BIPYRIDYL GROUP IS CONNECTED WITH PYRIDOINDOLE RING STRUCTURE THROUGH PHENYLENE GROUP, AND ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2010-05-20 US disclosed
EP-2128159-A1 COMPOUND WHEREIN SUBSTITUTED BIPYRIDYL GROUP IS CONNECTED WITH PYRIDOINDOLE RING STRUCTURE THROUGH PHENYLENE GROUP, AND ORGANIC ELECTROLUMINESCENT DEVICE Hodogaya Chemical Co., Ltd. (JP) 2009-12-02 EP 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-20100123388-A1 COMPOUND WHEREIN SUBSTITUTED BIPYRIDYL GROUP IS CONNECTED WITH PYRIDOINDOLE RING STRUCTURE THROUGH PHENYLENE GROUP, AND ORGANIC ELECTROLUMINESCENT DEVICE SLCO4C1, PNPO, EPHA1 PABPC1 2688/4885KDM4E 1051/4885MAPT 1944/4885

“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.