Gatifloxacin

Gatifloxacin

SCHEMBL4818151

COc1c(N2CCNC(C)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12.O.O.O

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

gyrAgyrBparCparE

The experimentally established mechanism targets of Gatifloxacin. 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 11/20 0.98
ALDH1A1 P00352 7/20 0.98
HPGD P15428 6/20 0.98
KCNH2 Q12809 4/20 0.98
HSD17B10 Q99714 4/20 0.98
POLB P06746 3/20 0.98
TDP1 Q9NUW8 2/20 0.98
OPRM1 P35372 2/20 0.98
PRKD3 O94806 1/20 0.98
ALOX15 P16050 1/20 0.98
CLK2 P49760 1/20 0.98
CLK4 Q9HAZ1 1/20 0.98
MEN1 O00255 1/20 0.69
KMT2A Q03164 1/20 0.69
LMNA P02545 2/20 0.67
CYP2C19 P33261 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
PMP22 Q01453 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
ATM Q13315 1/20 0.58

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
(S)-Gatifloxacin SCHEMBL1380257 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
Gatifloxacin SCHEMBL982406 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
Gatifloxacin SCHEMBL29765369 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
Gatifloxacin SCHEMBL3565683 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
(S)-Gatifloxacin SCHEMBL4818160 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
(S)-Gatifloxacin SCHEMBL1046589 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
Gatifloxacin SCHEMBL1380256 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
(S)-Gatifloxacin SCHEMBL3565686 1.00 KDM4E (0.98) KDM4EALDH1A1HPGDKCNH2HSD17B10
(R)-Gatifloxacin SCHEMBL5670068 0.99 KDM4E (1.00) KDM4EALDH1A1HPGDKCNH2HSD17B10
(S)-Gatifloxacin SCHEMBL30910969 0.99 KDM4E (1.00) KDM4EALDH1A1HPGDKCNH2HSD17B10

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269488-A1 Novel crystalline forms of gatifloxacin NIDDAM-HILDESHEIM VALERIE 2008-10-30 US disclosed
US-7411067-B2 Crystalline forms of gatifloxacin TEVA PHARMACEUTICAL INDUSTRIES LTD (IL) 2008-08-12 US disclosed
EP-1471911-A1 NOVEL CRYSTALLINE FORMS OF GATIFLOXACIN TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-11-03 EP disclosed
US-20040038988-A1 Novel crystalline forms of gatifloxacin TEVA PHARMACEUTICALS USA, INC. 2004-02-26 US disclosed
WO-2003105851-A1 NOVEL CRYSTALLINE FORMS OF GATIFLOXACIN TEVA PHARMACEUTICALS INDUSTRIES LTD. (IL) 2003-12-24 WO disclosed