Metronidazole

Metronidazole

SCHEMBL9833775

C=CC(O)n1ccnc1[N+](=O)[O-].Cc1ncc([N+](=O)[O-])n1CCO

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.61
MAPK1 P28482 2/20 0.61
ALDH1A1 P00352 2/20 0.61
THRB P10828 1/20 0.61
TSHR P16473 1/20 0.61
ATM Q13315 1/20 0.47
CHRM1 P11229 1/20 0.45
GLA P06280 1/20 0.43
CA1 P00915 5/20 0.43
CA2 P00918 5/20 0.43
CA9 Q16790 5/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA12 O43570 4/20 0.42
MAPT P10636 1/20 0.40
EGFR P00533 5/20 0.39
ERBB2 P04626 5/20 0.39
KMT2A Q03164 1/20 0.39

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
Metronidazole SCHEMBL6053140 0.80 LMNA (0.86) LMNAMAPK1ALDH1A1THRBTSHR
Metronidazole SCHEMBL5885668 0.80 LMNA (0.97) LMNAMAPK1ALDH1A1THRBTSHR
SCHEMBL9531382 0.80 KMT2A (0.42) LMNATHRBCA1CA2CA9
Metronidazole SCHEMBL21293782 0.78 LMNA (0.94) LMNAMAPK1ALDH1A1THRBTSHR
Metronidazole SCHEMBL29168722 0.78 LMNA (0.94) LMNAMAPK1ALDH1A1THRBTSHR
Metronidazole SCHEMBL9460595 0.78 LMNA (0.94) LMNAMAPK1ALDH1A1THRBTSHR
Metronidazole SCHEMBL28233371 0.78 LMNA (0.94) LMNAMAPK1ALDH1A1THRBTSHR
Metronidazole SCHEMBL6911811 0.78 LMNA (0.94) LMNAMAPK1ALDH1A1THRBTSHR
Metronidazole SCHEMBL2221140 0.78 LMNA (1.00) LMNAMAPK1ALDH1A1THRBTSHR
Metronidazole SCHEMBL9455119 0.78 LMNA (1.00) LMNAMAPK1ALDH1A1THRBTSHR

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
EP-0324691-B1 PROCESS FOR THE PREPARATION OF 1-HYDROXYALKYL-5-NITRO-IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-12-27 EP claimed