Fandofloxacin

Fandofloxacin

SCHEMBL1650236

CN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3-c2ccc(F)cn2)CC1.[Cl-].[H+]

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Fandofloxacin. 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 4/20 0.72
▸ MEN1 O00255 2/20 0.72
▸ KMT2A Q03164 2/20 0.72
▸ ALDH1A1 P00352 7/20 0.59
▸ DRD3 P35462 1/20 0.59
▸ KDM4E B2RXH2 8/20 0.55
▸ HPGD P15428 4/20 0.55
▸ HSD17B10 Q99714 4/20 0.55
▸ NPC1 O15118 1/20 0.54
▸ PIK3CG P48736 4/20 0.47
▸ GAA P10253 1/20 0.47
▸ RAD52 P43351 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ BRD4 O60885 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ CYP2J2 P51589 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46

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
Fandofloxacin SCHEMBL1650067 0.98 LMNA (0.74) LMNAMEN1KMT2AALDH1A1DRD3
Fandofloxacin SCHEMBL1230394 0.97 LMNA (0.73) LMNAMEN1KMT2AALDH1A1DRD3
SCHEMBL5195883 0.87 KMT2A (0.58) LMNAMEN1KMT2AALDH1A1DRD3
SCHEMBL8123703 0.87 LMNA (0.73) LMNAMEN1KMT2AALDH1A1DRD3
Hydrochloric Acid SCHEMBL8129182 0.86 LMNA (0.75) LMNAMEN1KMT2AALDH1A1DRD3
SCHEMBL8139807 0.86 MEN1 (0.57) LMNAMEN1KMT2AALDH1A1DRD3
Difloxacin SCHEMBL27973383 0.86 LMNA (0.96) LMNAMEN1KMT2AALDH1A1DRD3
Difloxacin SCHEMBL148765 0.84 LMNA (1.00) LMNAMEN1KMT2AALDH1A1DRD3
SCHEMBL10666385 0.84 LMNA (0.81) LMNAMEN1KMT2AALDH1A1DRD3
Difloxacin SCHEMBL29695838 0.84 LMNA (1.00) LMNAMEN1KMT2AALDH1A1DRD3

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
US-7927613-B2 Pharmaceutical co-crystal compositions UNIVERSITY OF SOUTH FLORIDA (US) 2011-04-19 — — US disclosed
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