Enrofloxacin

Enrofloxacin

SCHEMBL21776638

CCN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CC1.CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCNCC3)nc21

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

gyrAgyrBparCtopB

The experimentally established mechanism targets of Enrofloxacin. 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
▸ KDM4E B2RXH2 5/20 0.71
▸ ALDH1A1 P00352 5/20 0.71
▸ LMNA P02545 4/20 0.71
▸ HSD17B10 Q99714 4/20 0.71
▸ HPGD P15428 4/20 0.71
▸ MAPT P10636 1/20 0.71
▸ CYP2C9 P11712 2/20 0.70
▸ ATP6V1B2 P21281 1/20 0.70
▸ TBXA2R P21731 1/20 0.70
▸ EDNRA P25101 1/20 0.70
▸ TARBP2 Q15633 1/20 0.70
▸ TOP2B Q02880 2/20 0.67
▸ CYP1A2 P05177 1/20 0.67
▸ TOP2A P11388 1/20 0.67
▸ BRD4 O60885 1/20 0.62
▸ TSHR P16473 1/20 0.62
▸ HTT P42858 1/20 0.62
▸ CYP2J2 P51589 1/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.62
▸ DRD3 P35462 1/20 0.52

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
Ciprofloxacin SCHEMBL5029227 0.96 LMNA (0.75) KDM4EALDH1A1LMNAHSD17B10HPGD
Enrofloxacin SCHEMBL6044970 0.89 KDM4E (0.89) KDM4EALDH1A1LMNAHSD17B10HPGD
Norfloxacin SCHEMBL8387763 0.88 LMNA (0.84) KDM4EALDH1A1LMNAHSD17B10HPGD
SCHEMBL24321007 0.87 LMNA (0.60) KDM4EALDH1A1LMNAHSD17B10HPGD
Ciprofloxacin SCHEMBL5661134 0.86 ALDH1A1 (0.84) KDM4EALDH1A1LMNAHSD17B10HPGD
Pefloxacin SCHEMBL13725108 0.86 LMNA (0.77) KDM4EALDH1A1LMNAHSD17B10HPGD
Tosufloxacin SCHEMBL1965994 0.85 KMT2A (0.66) KDM4EALDH1A1LMNAHSD17B10HPGD
Ciprofloxacin SCHEMBL1701652 0.84 ALDH1A1 (0.81) KDM4EALDH1A1LMNAHSD17B10HPGD
Enrofloxacin SCHEMBL17554684 0.84 KDM4E (1.00) KDM4EALDH1A1LMNAHSD17B10HPGD
Enrofloxacin SCHEMBL149150 0.84 KDM4E (1.00) KDM4EALDH1A1LMNAHSD17B10HPGD

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-3820565-A1 BISPHOSPHONATE QUINOLONE CONJUGATES AND USES THEREOF Biovinc, LLC. (US) 2021-05-19 — — EP disclosed
WO-2020014269-A9 BISPHOSPHONATE QUINOLONE CONJUGATES AND USES THEREOF BIOVINC, LLC. (US) 2020-03-05 — — WO disclosed
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