BDBM52991 7-epi-Sclerotiorin::MLS000563216::SMR000470870::[(7S)-5-chloranyl-3-[(1E,5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-bis(oxidanylidene)isochromen-7-yl] ethanoate::[(7S)-5-chloro-3-[(1E,5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisochromen-7-yl] acetate::acetic acid [(7S)-5-chloro-3-[(1E,5S)-3,5-dimethylhepta-1,3-dienyl]-6,8-diketo-7-methyl-isochromen-7-yl] ester::acetic acid [(7S)-5-chloro-3-[(1E,5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxo-2-benzopyran-7-yl] ester::cid_23641101

SMILES: CC[C@H](C)C=C(C)\C=C\C1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CO1

InChI Key: InChIKey=SWJLTKXURNHVHE-UHFFFAOYSA-N

Data: 2 IC50  2 EC50

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 4 hits for monomerid = 52991   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Zinc finger protein mex-5 (Caenorhabditis elegans)	BDBM52991 (SMR000470870 | [(7S)-5-chloro-3-[(1E,5S)-3,5-dimet...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.78E+4	n/a	n/a	n/a	n/a
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POsterior Segregation (Caenorhabditis elegans)	BDBM52991 (SMR000470870 | [(7S)-5-chloro-3-[(1E,5S)-3,5-dimet...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.65E+5	n/a	n/a	n/a	n/a
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Hexokinase HKDC1 [W721R] (Human)	BDBM52991 (SMR000470870 | [(7S)-5-chloro-3-[(1E,5S)-3,5-dimet...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.68E+4	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Hexokinase HKDC1 [W721R] (Human)	BDBM52991 (SMR000470870 | [(7S)-5-chloro-3-[(1E,5S)-3,5-dimet...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair