Clinafloxacin

Clinafloxacin

SCHEMBL28466331

CS(=O)(=O)O.NC1CCN(c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2Cl)C1

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of Clinafloxacin. 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
CHRM1 known ✓ P11229 1/20 0.90
ALDH1A1 P00352 3/20 0.90
POLB P06746 2/20 0.90
OPRM1 P35372 2/20 0.90
CHRM2 P08172 1/20 0.90
OPRD1 P41143 1/20 0.90
KCNH2 Q12809 6/20 0.58
KDM4E B2RXH2 2/20 0.53
HPGD P15428 2/20 0.53
PRKD3 O94806 1/20 0.53
ALOX15 P16050 1/20 0.53
CLK2 P49760 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CLK4 Q9HAZ1 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
TOP2A P11388 6/20 0.51
TOP2B Q02880 4/20 0.51
TOP1 P11387 4/20 0.51

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
Clinafloxacin SCHEMBL8566142 0.96 ALDH1A1 (0.93) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL29360508 0.95 ALDH1A1 (1.00) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL33960 0.95 ALDH1A1 (1.00) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL8596801 0.95 ALDH1A1 (1.00) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL33959 0.95 ALDH1A1 (1.00) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL29288561 0.94 ALDH1A1 (0.98) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL193234 0.94 ALDH1A1 (0.98) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL29682535 0.94 ALDH1A1 (0.98) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL5571098 0.94 ALDH1A1 (0.98) ALDH1A1POLBOPRM1CHRM2CHRM1
Clinafloxacin SCHEMBL193233 0.94 ALDH1A1 (0.98) ALDH1A1POLBOPRM1CHRM2CHRM1

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
CN-111771895-A New application of quinolone compounds in preventing and treating plant bacterial diseases and citrus canker 兰州大学 2020-10-16 CN disclosed