BDBM50187960 CHEMBL212468::rac-6,9a-dimethyl-8,9,9a,10-tetrahydroindeno[2,1-e]indazol-7(3H)-one

SMILES: CC1=C2c3ccc4[nH]ncc4c3CC2(C)CCC1=O

InChI Key: InChIKey=LLOQNYZFGFKLEE-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50187960   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Estrogen receptor (Homo sapiens (Human))	BDBM50187960 (CHEMBL212468 | rac-6,9a-dimethyl-8,9,9a,10-tetrahy...) Show SMILES CC1=C2c3ccc4[nH]ncc4c3CC2(C)CCC1=O |c:1| Show InChI InChI=1S/C16H16N2O/c1-9-14(19)5-6-16(2)7-11-10(15(9)16)3-4-13-12(11)8-17-18-13/h3-4,8H,5-7H2,1-2H3,(H,17,18)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human ERalpha				Bioorg Med Chem Lett 16: 3896-901 (2006) Article DOI: 10.1016/j.bmcl.2006.05.036 BindingDB Entry DOI: 10.7270/Q24T6J01
					More data for this Ligand-Target Pair
Estradiol receptor beta (ERβ) (Homo sapiens (Human))	BDBM50187960 (CHEMBL212468 | rac-6,9a-dimethyl-8,9,9a,10-tetrahy...) Show SMILES CC1=C2c3ccc4[nH]ncc4c3CC2(C)CCC1=O |c:1| Show InChI InChI=1S/C16H16N2O/c1-9-14(19)5-6-16(2)7-11-10(15(9)16)3-4-13-12(11)8-17-18-13/h3-4,8H,5-7H2,1-2H3,(H,17,18)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human ERbeta				Bioorg Med Chem Lett 16: 3896-901 (2006) Article DOI: 10.1016/j.bmcl.2006.05.036 BindingDB Entry DOI: 10.7270/Q24T6J01
					More data for this Ligand-Target Pair