BDBM114662 4-(prop-2-ynylamino)benzoic acid ethyl ester::4-(propargylamino)benzoic acid ethyl ester::MLS000756461::SMR000528743::cid_305814::ethyl 4-(prop-2-ynylamino)benzoate

SMILES CCOC(=O)c1ccc(NCC#C)cc1

InChI Key InChIKey=KOEHTGGSAVSLRS-UHFFFAOYSA-N

Data  2 IC50

  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 2 hits for monomerid = 114662   

TargetFibrinogen beta chain [164-491](Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM114662(4-(prop-2-ynylamino)benzoic acid ethyl ester | 4-(...)
Affinity DataIC50:  2.77E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetFibrinogen beta chain [164-491](Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM114662(4-(prop-2-ynylamino)benzoic acid ethyl ester | 4-(...)
Affinity DataIC50:  8.31E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: Harvard Medical School/Massachuset...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay