Iodide

Iodide

SCHEMBL20873201

CC(C)(C)c1cc(NC(=O)Nc2ccc(-n3nc(-c4ccc(OC[N+](C)(C)C)cc4)c4c(N)ncnc43)cc2)no1.[I-]

nearest known ligand 0.74

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 15)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 20/20 0.74
▸ LCK P06239 1/20 0.74
▸ CSF1R P07333 1/20 0.74
▸ RET P07949 1/20 0.74
▸ PDGFRB P09619 1/20 0.74
▸ KIT P10721 1/20 0.74
▸ PDGFRA P16234 1/20 0.74
▸ CDK11B P21127 1/20 0.74
▸ CCNC P24863 1/20 0.74
▸ FLT4 P35916 1/20 0.74
▸ CDK8 P49336 1/20 0.74
▸ BTK Q06187 1/20 0.74
▸ DDR1 Q08345 1/20 0.74
▸ DDR2 Q16832 1/20 0.74
▸ MKNK2 Q9HBH9 1/20 0.74

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
SCHEMBL19683870 0.99 FLT3 (0.75) FLT3LCKCSF1RRETPDGFRB
SCHEMBL19683710 0.89 FLT3 (0.75) FLT3LCKCSF1RRETPDGFRB
SCHEMBL20873194 0.88 FLT3 (0.77) FLT3LCKCSF1RRETPDGFRB
SCHEMBL19683748 0.88 FLT3 (0.72) FLT3LCKCSF1RRETPDGFRB
SCHEMBL20873204 0.87 FLT3 (0.75) FLT3LCKCSF1RRETPDGFRB
Iodide SCHEMBL23190190 0.86 FLT3 (0.56) FLT3LCKCSF1RRETPDGFRB
SCHEMBL19683595 0.86 FLT3 (0.70) FLT3LCKCSF1RRETPDGFRB
SCHEMBL19683698 0.86 FLT3 (0.88) FLT3LCKCSF1RRETPDGFRB
SCHEMBL19683620 0.86 FLT3 (0.68) FLT3LCKCSF1RRETPDGFRB
SCHEMBL19683615 0.86 FLT3 (0.68) FLT3LCKCSF1RRETPDGFRB

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
EP-3466952-B1 1-(4-(4-AMINO-3-PHENYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-1-YL)-PHENYL)-UREA DERIVATIVES AS FLT3 KINASE INHIBITORS FOR TREATING CANCER PRECEDO PHARMACEUTICALS CO LTD (CN) 2021-03-03 — — EP disclosed
EP-3466952-A1 NOVEL INHIBITOR FOR FLT3 KINASE AND USES THEREOF Precedo Pharmaceuticals Co., Ltd. (CN) 2019-04-10 — — EP disclosed
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