BDBM50471081 CHEMBL1627420

SMILES: [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CCCO)c(O)cc3CC[C@@]21[H]

InChI Key: InChIKey=OMLNKIQCBRKHOW-OKSLILNBSA-N

Data: 3 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 3 hits for monomerid = 50471081   

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))	BDBM50471081 (CHEMBL1627420) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CCCO)c(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C21H30O3/c1-21-9-8-15-16(18(21)6-7-20(21)24)5-4-13-12-19(23)14(3-2-10-22)11-17(13)15/h11-12,15-16,18,20,22-24H,2-10H2,1H3/t15-,16+,18-,20-,21-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	495	n/a	n/a	n/a	n/a
Ohio State University Curated by ChEMBL					Assay Description Induction of pS2 mRNA expression in human MCF-7 mammary carcinoma cells				J Med Chem 39: 1917-23 (1996) Article DOI: 10.1021/jm9508245 BindingDB Entry DOI: 10.7270/Q21G0Q0F
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50471081 (CHEMBL1627420) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CCCO)c(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C21H30O3/c1-21-9-8-15-16(18(21)6-7-20(21)24)5-4-13-12-19(23)14(3-2-10-22)11-17(13)15/h11-12,15-16,18,20,22-24H,2-10H2,1H3/t15-,16+,18-,20-,21-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.00400	n/a	n/a	n/a	n/a
Ohio State University Curated by ChEMBL					Assay Description Induction of pS2 mRNA expression in human MCF-7 mammary carcinoma cells				J Med Chem 39: 1917-23 (1996) Article DOI: 10.1021/jm9508245 BindingDB Entry DOI: 10.7270/Q21G0Q0F
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50471081 (CHEMBL1627420) Show SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3cc(CCCO)c(O)cc3CC[C@@]21[H] Show InChI InChI=1S/C21H30O3/c1-21-9-8-15-16(18(21)6-7-20(21)24)5-4-13-12-19(23)14(3-2-10-22)11-17(13)15/h11-12,15-16,18,20,22-24H,2-10H2,1H3/t15-,16+,18-,20-,21-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.22E+3	n/a	n/a	n/a	n/a
Ohio State University Curated by ChEMBL					Assay Description Affinity estrogen receptor of MCF-7 human mammary cancer cells				J Med Chem 39: 1917-23 (1996) Article DOI: 10.1021/jm9508245 BindingDB Entry DOI: 10.7270/Q21G0Q0F
					More data for this Ligand-Target Pair