Sulfadoxine

Sulfadoxine

SCHEMBL30005494

[2H]C([2H])([2H])Oc1ncnc(NS(=O)(=O)c2ccc(N)cc2)c1OC

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPPK-DHPS

The experimentally established mechanism targets of Sulfadoxine. 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
ESR1 P03372 1/20 0.86
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
CYP2C19 P33261 2/20 0.51
LMNA P02545 5/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
HTR6 P50406 2/20 0.42
CYP19A1 P11511 1/20 0.42
ALDH1A1 P00352 3/20 0.42
EDNRA P25101 2/20 0.42
CYP3A4 P08684 1/20 0.42
AURKA O14965 1/20 0.42
DHFR P00374 1/20 0.42
TSHR P16473 1/20 0.42
KDM4E B2RXH2 2/20 0.41
CYP2C9 P11712 1/20 0.41
SLC6A4 P31645 1/20 0.41
ADRA1A P35348 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
Sulfadoxine SCHEMBL41069 0.92 ESR1 (1.00) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL29390814 0.92 ESR1 (1.00) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL27856131 0.91 ESR1 (0.97) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL28436237 0.91 ESR1 (0.97) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL28359083 0.91 ESR1 (0.97) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL28537335 0.91 ESR1 (0.97) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL615997 0.88 ESR1 (0.90) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL28122268 0.87 ESR1 (0.88) ESR1MEN1KMT2ACYP2C19LMNA
Sulfadoxine SCHEMBL28198178 0.84 ESR1 (0.82) ESR1MEN1KMT2ACYP2C19LMNA
SCHEMBL27971500 0.81 ESR1 (0.74) ESR1MEN1KMT2ACYP2C19LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115128187-A Method for determining antibiotic medicines in liquid Chinese herbal medicine preparation for fishing 福建省水产研究所(福建水产病害防治中心) 2022-09-30 CN disclosed