Metronidazole

Metronidazole

SCHEMBL3453244

Cc1ncc([N+](=O)[O-])n1CCO.[S]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.97
ALDH1A1 P00352 3/20 0.97
MAPK1 P28482 2/20 0.97
THRB P10828 1/20 0.97
TSHR P16473 1/20 0.97
CA1 P00915 5/20 0.62
CA2 P00918 5/20 0.62
CA9 Q16790 5/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
GLA P06280 1/20 0.62
ATM Q13315 1/20 0.61
CA12 O43570 4/20 0.58
CHRM1 P11229 1/20 0.57
GAA P10253 1/20 0.55
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.52
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
EGFR P00533 2/20 0.50
ERBB2 P04626 2/20 0.50

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 SCHEMBL9482744 0.98 LMNA (1.00) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL31108924 0.98 LMNA (1.00) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL23042 0.98 LMNA (1.00) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL5313560 0.98 LMNA (1.00) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL2221140 0.98 LMNA (1.00) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL9481347 0.98 LMNA (1.00) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL9455119 0.98 LMNA (1.00) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL5595814 0.97 LMNA (0.97) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL8667859 0.97 LMNA (0.97) LMNAALDH1A1MAPK1THRBTSHR
Metronidazole SCHEMBL8675069 0.97 LMNA (0.97) LMNAALDH1A1MAPK1THRBTSHR

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
WO-2014027006-A1 BIOADHESIVE FORMULATIONS FOR USE IN DRUG DELIVERY EDKO PAZARLAMA TANITIM TICARET LIMITED SIRKETI (TR) 2014-02-20 WO disclosed
US-7763164-B1 Gasoline sulfur reduction in FCCU cracking MARATHON PETROLEUM COMPANY LLC (US) 2010-07-27 US disclosed
US-5800797-A USED FOR CATALYST SUPPORT OR ADSORBENT CATALYSTS & CHEMICALS INDUSTRIES CO., LTD. (JP) 1998-09-01 US disclosed