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BDBM95537 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxylic acid [(Z)-[amino-(5-nitro-2-furanyl)methylidene]amino] ester::3-(2-chlorophenyl)-5-methyl-isoxazole-4-carboxylic acid [(Z)-[amino-(5-nitro-2-furyl)methylene]amino] ester::MLS000861278::O2-{[3-(2-chlorophenyl)-5-methylisoxazol-4-yl]carbonyl}-5-nitrofuran-2-carbohydroximamide::SMR000460062::[(Z)-[amino-(5-nitrofuran-2-yl)methylidene]amino] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate::[(Z)-[azanyl-(5-nitrofuran-2-yl)methylidene]amino] 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate::cid_9566277

SMILES: Cc1onc(c1C(=O)O[N-]C(=[NH2+])c1ccc(o1)[N+]([O-])=O)-c1ccccc1Cl

InChI Key: InChIKey=RXQUHDYKVAWVOV-UHFFFAOYSA-O

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 95537   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
nuclear receptor subfamily 5 group A member 2 isoform 2


(Homo sapiens (Human))
BDBM95537
PNG
(3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxylic ...)
Show SMILES Cc1onc(c1C(=O)ON=C(N)c1ccc(o1)[N+]([O-])=O)-c1ccccc1Cl
Show InChI InChI=1S/C16H10ClN4O6/c1-8-13(14(19-26-8)9-4-2-3-5-10(9)17)16(22)27-20-15(18)11-6-7-12(25-11)21(23)24/h2-7H,1H3,(H-,18,20)/q-1/p+1
PDB
MMDB

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PC sid
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Similars

PCBioAssay
n/an/a 495n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q22F7M18
More data for this
Ligand-Target Pair