BDBM50240982 (E)-(7S,11S)-2,4,11-Trihydroxy-7-methyl-7,8,9,10,11,12,13,14-octahydro-6-oxa-benzocyclotetradecen-5-one::BETA-ZEARALENOL::CHEMBL372840::cid_107645

SMILES: C[C@H]1CCC[C@H](CCC/C=C/c2cc(cc(c2C(=O)O1)O)O)O

InChI Key: InChIKey=FPQFYIAXQDXNOR-UHFFFAOYSA-N

Data: 2 IC50  1 EC50

PDB links: 4 PDB IDs match this monomer.

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 3 hits for monomerid = 50240982   

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
Estrogen receptor (Human)	BDBM50240982 ((E)-(7S,11S)-2,4,11-Trihydroxy-7-methyl-7,8,9,10,1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	9.22E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Signal transducer and activator of transcription 3 [702-738,740-752] (Human)	BDBM50240982 ((E)-(7S,11S)-2,4,11-Trihydroxy-7-methyl-7,8,9,10,1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Signal transducer and activator of transcription 1-alpha/beta (Human)	BDBM50240982 ((E)-(7S,11S)-2,4,11-Trihydroxy-7-methyl-7,8,9,10,1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>5.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair