BDBM94041 (2S)-2-[3-(2-keto-4-methyl-6,7,8,9-tetrahydrobenzofuro[3,2-g]chromen-3-yl)propanoylamino]-4-methyl-valeric acid::(2S)-4-methyl-2-[3-(4-methyl-2-oxidanylidene-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid::(2S)-4-methyl-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid::(2S)-4-methyl-2-[[3-(4-methyl-2-oxo-6,7,8,9-tetrahydrobenzofuro[3,2-g][1]benzopyran-3-yl)-1-oxopropyl]amino]pentanoic acid::MLS001214755::SMR000543474::cid_1756351

SMILES CC(C)C[C@H](NC(=O)CCc1c(C)c2cc3c4CCCCc4oc3cc2oc1=O)C(O)=O

InChI Key InChIKey=MCSJIJZKLQXAGC-IBGZPJMESA-N

Data  1 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 1 hit for monomerid = 94041   

TargetEndothelial PAS domain-containing protein 1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM94041((2S)-2-[3-(2-keto-4-methyl-6,7,8,9-tetrahydrobenzo...)
Affinity DataIC50:  1.61E+3nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay