Fluorouracil

Fluorouracil

SCHEMBL18529971

CC(=O)C(=O)O.O=c1[nH]cc(F)c(=O)[nH]1

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TYMS

The experimentally established mechanism targets of Fluorouracil. 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
LMNA P02545 3/20 0.70
ALDH1A1 P00352 3/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
MAPT P10636 1/20 0.70
CYP19A1 P11511 1/20 0.70
TSHR P16473 1/20 0.70
THPO P40225 1/20 0.70
MTOR P42345 1/20 0.70
HTT P42858 1/20 0.70
HBB P68871 1/20 0.70
PMP22 Q01453 1/20 0.70
GAA P10253 1/20 0.44
ATAD2 Q6PL18 1/20 0.44
DPYD Q12882 4/20 0.39
JAK2 O60674 1/20 0.36
THRB P10828 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36

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
Fluorouracil SCHEMBL27747751 0.92 LMNA (0.76) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1
Fluorouracil SCHEMBL27927726 0.86 LMNA (0.86) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1
Fluorouracil SCHEMBL21525858 0.85 LMNA (0.76) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1
Fluorouracil SCHEMBL30516153 0.84 LMNA (0.63) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1
Fluorouracil SCHEMBL3646 0.84
Fluorouracil SCHEMBL10017187 0.84
Fluorouracil SCHEMBL28206325 0.84 LMNA (0.68) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1
Fluorouracil SCHEMBL2816434 0.82 LMNA (0.79) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1
Fluorouracil SCHEMBL21527805 0.82 MAPT (0.95) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1
Fluorouracil SCHEMBL21880166 0.82 MAPT (0.95) LMNAALDH1A1SMN1; SMN2MAPTCYP19A1

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-3334471-A1 METHOD OF TREATING A DISEASE USING A GLYCOLYTIC DEPENDENT COMPOUND Ethicon, Inc. (US) 2018-06-20 EP disclosed
WO-2017030908-A1 METHOD OF TREATING A DISEASE USING A GLYCOLYTIC DEPENDENT COMPOUND ETHICON, INC. (US) 2017-02-23 WO disclosed