Iodide

Iodide

SCHEMBL10352303

CCN(CC[n+]1ccccc1)c1ccc(/N=N/c2ncc([N+](=O)[O-])s2)c(C)c1.[I-]

nearest known ligand 0.62

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 18)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.62
▸ MEN1 O00255 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ MMP14 P50281 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ STAT3 P40763 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ PTBP1 P26599 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 SCHEMBL10352304 1.00 KDR (0.62) KDRMEN1LMNAMAPTKMT2A
SCHEMBL2769400 0.99 KDR (0.63) KDRMEN1LMNAMAPTKMT2A
SCHEMBL2769405 0.99 KDR (0.63) KDRMEN1LMNAMAPTKMT2A
Bromide SCHEMBL2770147 0.98 KDR (0.62) KDRMEN1LMNAMAPTKMT2A
Bromide SCHEMBL2773473 0.98 KDR (0.62) KDRMEN1LMNAMAPTKMT2A
SCHEMBL2771487 0.89 KDR (0.52) KDR
SCHEMBL2771485 0.89 KDR (0.52) KDR
Bromide SCHEMBL2771712 0.88 KDR (0.51) KDR
Bromide SCHEMBL2771464 0.88 KDR (0.51) KDR
SCHEMBL17038721 0.87 KDR (0.73) KDRMEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0178832-B1 THERMAL TRANSFER PRINTING IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-20 — — EP disclosed
US-4664671-A BRIGHT, GLOSSY, DENSE IMAGES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-05-12 — — US disclosed
EP-0178832-A2 Thermal transfer printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-23 — — EP disclosed
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