BDBM100087 (4S)-6-amino-5-cyano-2-(2-keto-2-methoxy-ethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylic acid methyl ester::(4S)-6-amino-5-cyano-2-(2-methoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylic acid methyl ester::(S)-6-Amino-5-cyano-2-methoxycarbonylmethyl-4-(2-nitro-phenyl)-4H-pyran-3-carboxylic acid methyl ester::MLS000779953::SMR000420118::cid_7211646::methyl (4S)-6-amino-5-cyano-2-(2-methoxy-2-oxoethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate::methyl (4S)-6-azanyl-5-cyano-2-(2-methoxy-2-oxidanylidene-ethyl)-4-(2-nitrophenyl)-4H-pyran-3-carboxylate

SMILES COC(=O)CC1=C(C([C-](C#N)C(=[NH2+])O1)c1ccccc1[N+]([O-])=O)C(=O)OC

InChI Key InChIKey=HUQUMLONTWNECO-UHFFFAOYSA-O

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 100087   

TargetKallikrein-7(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM100087((4S)-6-amino-5-cyano-2-(2-keto-2-methoxy-ethyl)-4-...)
Affinity DataEC50:  8.20E+3nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay