Compile Data Set for Download or QSAR

Found 277 hits with Last Name = 'parent' and Initial = 'aa'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Estrogen receptor (Homo sapiens (Human))	BDBM50253424 (CHEMBL495337 | N4-Benzyl-N2-isobutyl-6-phenethyl-p...) Show SMILES CC(C)CNc1nc(CCc2ccccc2)cc(NCc2ccccc2)n1 Show InChI InChI=1S/C23H28N4/c1-18(2)16-25-23-26-21(14-13-19-9-5-3-6-10-19)15-22(27-23)24-17-20-11-7-4-8-12-20/h3-12,15,18H,13-14,16-17H2,1-2H3,(H2,24,25,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253391 (CHEMBL495326 | N4-methyl-N2,N4-diisobutyl-6-[(2-na...) Show SMILES CC(C)CNc1nc(CCc2cccc3ccccc23)cc(n1)N(C)CC(C)C Show InChI InChI=1S/C25H34N4/c1-18(2)16-26-25-27-22(15-24(28-25)29(5)17-19(3)4)14-13-21-11-8-10-20-9-6-7-12-23(20)21/h6-12,15,18-19H,13-14,16-17H2,1-5H3,(H,26,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253442 (CHEMBL494698 | N2-Isobutyl-6-(3-methyl-butyl)-N4-n...) Show SMILES CC(C)CCc1cc(NCc2cccc3ccccc23)nc(NCC(C)C)n1 Show InChI InChI=1S/C24H32N4/c1-17(2)12-13-21-14-23(28-24(27-21)26-15-18(3)4)25-16-20-10-7-9-19-8-5-6-11-22(19)20/h5-11,14,17-18H,12-13,15-16H2,1-4H3,(H2,25,26,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253326 (CHEMBL493490 | N,N-Diisobutyl-(6-styryl-pyrimidin-...) Show SMILES CC(C)CNc1cc(\C=C\c2ccccc2)nc(NCC(C)C)n1 Show InChI InChI=1S/C20H28N4/c1-15(2)13-21-19-12-18(11-10-17-8-6-5-7-9-17)23-20(24-19)22-14-16(3)4/h5-12,15-16H,13-14H2,1-4H3,(H2,21,22,23,24)/b11-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.42E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253431 (2,4-diisobutylamino-6-(1-naphthylethyl)-pyrimidine...) Show SMILES CC(C)CNc1cc(CCc2cccc3ccccc23)nc(NCC(C)C)n1 Show InChI InChI=1S/C24H32N4/c1-17(2)15-25-23-14-21(27-24(28-23)26-16-18(3)4)13-12-20-10-7-9-19-8-5-6-11-22(19)20/h5-11,14,17-18H,12-13,15-16H2,1-4H3,(H2,25,26,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50138886 (2,4-diisobutylamino-6-isopentylpyrimidine | CHEMBL...) Show SMILES CC(C)CCc1cc(NCC(C)C)nc(NCC(C)C)n1 Show InChI InChI=1S/C17H32N4/c1-12(2)7-8-15-9-16(18-10-13(3)4)21-17(20-15)19-11-14(5)6/h9,12-14H,7-8,10-11H2,1-6H3,(H2,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50138886 (2,4-diisobutylamino-6-isopentylpyrimidine | CHEMBL...) Show SMILES CC(C)CCc1cc(NCC(C)C)nc(NCC(C)C)n1 Show InChI InChI=1S/C17H32N4/c1-12(2)7-8-15-9-16(18-10-13(3)4)21-17(20-15)19-11-14(5)6/h9,12-14H,7-8,10-11H2,1-6H3,(H2,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of steroid receptor coactivator 2 interaction by fluorescence polarization assay				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253354 (2,4-Dibenzylamino-6-isopentylpyrimidine | CHEMBL49...) Show SMILES CC(C)CCc1cc(NCc2ccccc2)nc(NCc2ccccc2)n1 Show InChI InChI=1S/C23H28N4/c1-18(2)13-14-21-15-22(24-16-19-9-5-3-6-10-19)27-23(26-21)25-17-20-11-7-4-8-12-20/h3-12,15,18H,13-14,16-17H2,1-2H3,(H2,24,25,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253380 (CHEMBL494706 | N,N,N-Triisobutyl-pyrimidine-2,4,6-...) Show SMILES CC(C)CNc1cc(NCC(C)C)nc(NCC(C)C)n1 Show InChI InChI=1S/C16H31N5/c1-11(2)8-17-14-7-15(18-9-12(3)4)21-16(20-14)19-10-13(5)6/h7,11-13H,8-10H2,1-6H3,(H3,17,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253343 (CHEMBL494717 | N,N-diisobutyl-(6-phenethyl-pyrimid...) Show SMILES CC(C)CNc1cc(CCc2ccccc2)nc(NCC(C)C)n1 Show InChI InChI=1S/C20H30N4/c1-15(2)13-21-19-12-18(11-10-17-8-6-5-7-9-17)23-20(24-19)22-14-16(3)4/h5-9,12,15-16H,10-11,13-14H2,1-4H3,(H2,21,22,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253440 (CHEMBL494493 | N4-Benzyl-N2-isobutyl-6-(3-methyl-b...) Show SMILES CC(C)CCc1cc(NCc2ccccc2)nc(NCC(C)C)n1 Show InChI InChI=1S/C20H30N4/c1-15(2)10-11-18-12-19(21-14-17-8-6-5-7-9-17)24-20(23-18)22-13-16(3)4/h5-9,12,15-16H,10-11,13-14H2,1-4H3,(H2,21,22,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253462 (CHEMBL451143 | N2-dimethyl-N2,N4-diisobutyl-(6-iso...) Show SMILES CC(C)CCc1cc(NCC(C)C)nc(n1)N(C)CC(C)C Show InChI InChI=1S/C18H34N4/c1-13(2)8-9-16-10-17(19-11-14(3)4)21-18(20-16)22(7)12-15(5)6/h10,13-15H,8-9,11-12H2,1-7H3,(H,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253369 (CHEMBL494492 | N4-Isobutyl-6-(3-methyl-butyl)-N2-n...) Show SMILES CC(C)CCc1cc(NCC(C)C)nc(NCc2cccc3ccccc23)n1 Show InChI InChI=1S/C24H32N4/c1-17(2)12-13-21-14-23(25-15-18(3)4)28-24(27-21)26-16-20-10-7-9-19-8-5-6-11-22(19)20/h5-11,14,17-18H,12-13,15-16H2,1-4H3,(H2,25,26,27,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253458 (4-benzyl-2,6-diisobutylamino-pyrimidine | CHEMBL49...) Show SMILES CC(C)CNc1cc(NCc2ccccc2)nc(NCC(C)C)n1 Show InChI InChI=1S/C19H29N5/c1-14(2)11-20-17-10-18(21-13-16-8-6-5-7-9-16)24-19(23-17)22-12-15(3)4/h5-10,14-15H,11-13H2,1-4H3,(H3,20,21,22,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253457 (2,4-Diisobutylamino-6-chloropyrimidine | CHEMBL493...) Show SMILES CC(C)CNc1cc(NCC(C)C)nc(Cl)n1 Show InChI InChI=1S/C12H21ClN4/c1-8(2)6-14-10-5-11(15-7-9(3)4)17-12(13)16-10/h5,8-9H,6-7H2,1-4H3,(H2,14,15,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253326 (CHEMBL493490 | N,N-Diisobutyl-(6-styryl-pyrimidin-...) Show SMILES CC(C)CNc1cc(\C=C\c2ccccc2)nc(NCC(C)C)n1 Show InChI InChI=1S/C20H28N4/c1-15(2)13-21-19-12-18(11-10-17-8-6-5-7-9-17)23-20(24-19)22-14-16(3)4/h5-12,15-16H,13-14H2,1-4H3,(H2,21,22,23,24)/b11-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253351 (CHEMBL495135 | N2-Benzyl-N4-isobutyl-6-phenethyl-p...) Show SMILES CC(C)CNc1cc(CCc2ccccc2)nc(NCc2ccccc2)n1 Show InChI InChI=1S/C23H28N4/c1-18(2)16-24-22-15-21(14-13-19-9-5-3-6-10-19)26-23(27-22)25-17-20-11-7-4-8-12-20/h3-12,15,18H,13-14,16-17H2,1-2H3,(H2,24,25,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253367 (CHEMBL494491 | N2-Benzyl-N4-isobutyl-6-(3-methyl-b...) Show SMILES CC(C)CCc1cc(NCC(C)C)nc(NCc2ccccc2)n1 Show InChI InChI=1S/C20H30N4/c1-15(2)10-11-18-12-19(21-13-16(3)4)24-20(23-18)22-14-17-8-6-5-7-9-17/h5-9,12,15-16H,10-11,13-14H2,1-4H3,(H2,21,22,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253465 (CHEMBL492875 | N4-Dimethyl-N2,N4-diisobutyl-(6-phe...) Show SMILES CC(C)CNc1nc(CCc2ccccc2)cc(n1)N(C)CC(C)C Show InChI InChI=1S/C21H32N4/c1-16(2)14-22-21-23-19(12-11-18-9-7-6-8-10-18)13-20(24-21)25(5)15-17(3)4/h6-10,13,16-17H,11-12,14-15H2,1-5H3,(H,22,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253368 (6-ethyl-2,4-diisobutylaminopyrimidine | CHEMBL4844...) Show SMILES CCc1cc(NCC(C)C)nc(NCC(C)C)n1 Show InChI InChI=1S/C14H26N4/c1-6-12-7-13(15-8-10(2)3)18-14(17-12)16-9-11(4)5/h7,10-11H,6,8-9H2,1-5H3,(H2,15,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50138883 (6-Butyl-N*2*,N*4*-dipropyl-pyrimidine-2,4-diamine ...) Show SMILES CCCCc1cc(NCCC)nc(NCCC)n1 Show InChI InChI=1S/C14H26N4/c1-4-7-8-12-11-13(15-9-5-2)18-14(17-12)16-10-6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253422 (CHEMBL493097 | N4-Benzyl-N2-isobutyl-6-styryl-pyri...) Show SMILES CC(C)CNc1nc(NCc2ccccc2)cc(\C=C\c2ccccc2)n1 Show InChI InChI=1S/C23H26N4/c1-18(2)16-25-23-26-21(14-13-19-9-5-3-6-10-19)15-22(27-23)24-17-20-11-7-4-8-12-20/h3-15,18H,16-17H2,1-2H3,(H2,24,25,26,27)/b14-13+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50138883 (6-Butyl-N*2*,N*4*-dipropyl-pyrimidine-2,4-diamine ...) Show SMILES CCCCc1cc(NCCC)nc(NCCC)n1 Show InChI InChI=1S/C14H26N4/c1-4-7-8-12-11-13(15-9-5-2)18-14(17-12)16-10-6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of steroid receptor coactivator 2 interaction by fluorescence polarization assay				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50138886 (2,4-diisobutylamino-6-isopentylpyrimidine | CHEMBL...) Show SMILES CC(C)CCc1cc(NCC(C)C)nc(NCC(C)C)n1 Show InChI InChI=1S/C17H32N4/c1-12(2)7-8-15-9-16(18-10-13(3)4)21-17(20-15)19-11-14(5)6/h9,12-14H,7-8,10-11H2,1-6H3,(H2,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of steroid receptor coactivator 2 interaction by fluorescence polarization assay				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50138883 (6-Butyl-N*2*,N*4*-dipropyl-pyrimidine-2,4-diamine ...) Show SMILES CCCCc1cc(NCCC)nc(NCCC)n1 Show InChI InChI=1S/C14H26N4/c1-4-7-8-12-11-13(15-9-5-2)18-14(17-12)16-10-6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of steroid receptor coactivator 2 interaction by fluorescence polarization assay				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50138887 (CHEMBL158017 | N*2*,N*4*-Dibenzyl-6-phenethyl-pyri...) Show SMILES C(Cc1cc(NCc2ccccc2)nc(NCc2ccccc2)n1)c1ccccc1 Show InChI InChI=1S/C26H26N4/c1-4-10-21(11-5-1)16-17-24-18-25(27-19-22-12-6-2-7-13-22)30-26(29-24)28-20-23-14-8-3-9-15-23/h1-15,18H,16-17,19-20H2,(H2,27,28,29,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of steroid receptor coactivator 2 interaction by fluorescence polarization assay				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253346 (Benzyl-(2-isobutylamino-6-styryl-pyrimidin-4-yl)-c...) Show SMILES CC(C)CNc1nc(\C=C\c2ccccc2)cc(n1)N(Cc1ccccc1)C(=O)OC(C)(C)C Show InChI InChI=1S/C28H34N4O2/c1-21(2)19-29-26-30-24(17-16-22-12-8-6-9-13-22)18-25(31-26)32(27(33)34-28(3,4)5)20-23-14-10-7-11-15-23/h6-18,21H,19-20H2,1-5H3,(H,29,30,31)/b17-16+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.32E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253380 (CHEMBL494706 | N,N,N-Triisobutyl-pyrimidine-2,4,6-...) Show SMILES CC(C)CNc1cc(NCC(C)C)nc(NCC(C)C)n1 Show InChI InChI=1S/C16H31N5/c1-11(2)8-17-14-7-15(18-9-12(3)4)21-16(20-14)19-10-13(5)6/h7,11-13H,8-10H2,1-6H3,(H3,17,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.99E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253462 (CHEMBL451143 | N2-dimethyl-N2,N4-diisobutyl-(6-iso...) Show SMILES CC(C)CCc1cc(NCC(C)C)nc(n1)N(C)CC(C)C Show InChI InChI=1S/C18H34N4/c1-13(2)8-9-16-10-17(19-11-14(3)4)21-18(20-16)22(7)12-15(5)6/h10,13-15H,8-9,11-12H2,1-7H3,(H,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253461 (CHEMBL522663 | N2,N4-dimethyl-N2,N4-diisobutyl-(6-...) Show SMILES CC(C)CN(C)c1cc(CCc2ccccc2)nc(n1)N(C)CC(C)C Show InChI InChI=1S/C22H34N4/c1-17(2)15-25(5)21-14-20(13-12-19-10-8-7-9-11-19)23-22(24-21)26(6)16-18(3)4/h7-11,14,17-18H,12-13,15-16H2,1-6H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253460 (CHEMBL493904 | N2,N4-dimethyl-N2,N4-diisobutyl-6-[...) Show SMILES CC(C)CN(C)c1cc(CCc2cccc3ccccc23)nc(n1)N(C)CC(C)C Show InChI InChI=1S/C26H36N4/c1-19(2)17-29(5)25-16-23(27-26(28-25)30(6)18-20(3)4)15-14-22-12-9-11-21-10-7-8-13-24(21)22/h7-13,16,19-20H,14-15,17-18H2,1-6H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253387 (CHEMBL492665 | N2,N4-dimethyl-N2,N4-diisobutyl-(6-...) Show SMILES CC(C)CN(C)c1cc(\C=C\c2ccccc2)nc(n1)N(C)CC(C)C Show InChI InChI=1S/C22H32N4/c1-17(2)15-25(5)21-14-20(13-12-19-10-8-7-9-11-19)23-22(24-21)26(6)16-18(3)4/h7-14,17-18H,15-16H2,1-6H3/b13-12+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253386 (CHEMBL449931 | N2,N4-Dimethyl-N2,N4-diisobutyl-(6-...) Show SMILES CC(C)CCc1cc(nc(n1)N(C)CC(C)C)N(C)CC(C)C Show InChI InChI=1S/C19H36N4/c1-14(2)9-10-17-11-18(22(7)12-15(3)4)21-19(20-17)23(8)13-16(5)6/h11,14-16H,9-10,12-13H2,1-8H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor beta (Homo sapiens (Human))	BDBM50253385 (4-isobutylsulfonyl-2,6-diisobutylamino-pyrimidine ...) Show SMILES CC(C)CNc1cc(nc(NCC(C)C)n1)S(=O)(=O)CC(C)C Show InChI InChI=1S/C16H30N4O2S/c1-11(2)8-17-14-7-15(23(21,22)10-13(5)6)20-16(19-14)18-9-12(3)4/h7,11-13H,8-10H2,1-6H3,(H2,17,18,19,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERbeta (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 b...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253356 (2,4-Bis-isobutylsulfanyl-6-(3-methyl-butyl)-pyrimi...) Show SMILES CC(C)CCc1cc(SCC(C)C)nc(SCC(C)C)n1 Show InChI InChI=1S/C17H30N2S2/c1-12(2)7-8-15-9-16(20-10-13(3)4)19-17(18-15)21-11-14(5)6/h9,12-14H,7-8,10-11H2,1-6H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253430 (2,4-Bis-benzyloxy-6-(3-methyl-butyl)-pyrimidine | ...) Show SMILES CC(C)CCc1cc(OCc2ccccc2)nc(OCc2ccccc2)n1 Show InChI InChI=1S/C23H26N2O2/c1-18(2)13-14-21-15-22(26-16-19-9-5-3-6-10-19)25-23(24-21)27-17-20-11-7-4-8-12-20/h3-12,15,18H,13-14,16-17H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253429 (2,4-Diisobutoxy-6-(3-methyl-butyl)-pyrimidine | CH...) Show SMILES CC(C)CCc1cc(OCC(C)C)nc(OCC(C)C)n1 Show InChI InChI=1S/C17H30N2O2/c1-12(2)7-8-15-9-16(20-10-13(3)4)19-17(18-15)21-11-14(5)6/h9,12-14H,7-8,10-11H2,1-6H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253428 (2,4-dinaphthylen-1-ylmethylamino-6-isopentylpyrimi...) Show SMILES CC(C)CCc1cc(NCc2cccc3ccccc23)nc(NCc2cccc3ccccc23)n1 Show InChI InChI=1S/C31H32N4/c1-22(2)17-18-27-19-30(32-20-25-13-7-11-23-9-3-5-15-28(23)25)35-31(34-27)33-21-26-14-8-12-24-10-4-6-16-29(24)26/h3-16,19,22H,17-18,20-21H2,1-2H3,(H2,32,33,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253353 (CHEMBL495136 | N2-Benzyl-N4-naphthalen-1-ylmethyl-...) Show SMILES C(Cc1cc(NCc2cccc3ccccc23)nc(NCc2ccccc2)n1)c1ccccc1 Show InChI InChI=1S/C30H28N4/c1-3-10-23(11-4-1)18-19-27-20-29(34-30(33-27)32-21-24-12-5-2-6-13-24)31-22-26-16-9-15-25-14-7-8-17-28(25)26/h1-17,20H,18-19,21-22H2,(H2,31,32,33,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253426 (CHEMBL495338 | N2-Isobutyl-N4-naphthalen-1-ylmethy...) Show SMILES CC(C)CNc1nc(CCc2ccccc2)cc(NCc2cccc3ccccc23)n1 Show InChI InChI=1S/C27H30N4/c1-20(2)18-29-27-30-24(16-15-21-9-4-3-5-10-21)17-26(31-27)28-19-23-13-8-12-22-11-6-7-14-25(22)23/h3-14,17,20H,15-16,18-19H2,1-2H3,(H2,28,29,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253425 (CHEMBL522542 | N4-Benzyl-N2-naphthalen-1-ylmethyl-...) Show SMILES C(Cc1cc(NCc2ccccc2)nc(NCc2cccc3ccccc23)n1)c1ccccc1 Show InChI InChI=1S/C30H28N4/c1-3-10-23(11-4-1)18-19-27-20-29(31-21-24-12-5-2-6-13-24)34-30(33-27)32-22-26-16-9-15-25-14-7-8-17-28(25)26/h1-17,20H,18-19,21-22H2,(H2,31,32,33,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253423 (CHEMBL495137 | N4-Isobutyl-N2-naphthalen-1-ylmethy...) Show SMILES CC(C)CNc1cc(CCc2ccccc2)nc(NCc2cccc3ccccc23)n1 Show InChI InChI=1S/C27H30N4/c1-20(2)18-28-26-17-24(16-15-21-9-4-3-5-10-21)30-27(31-26)29-19-23-13-8-12-22-11-6-7-14-25(22)23/h3-14,17,20H,15-16,18-19H2,1-2H3,(H2,28,29,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253350 (CHEMBL492890 | N,N-Dinaphthalen-1-ylmethyl-(6-styr...) Show SMILES C(Nc1cc(\C=C\c2ccccc2)nc(NCc2cccc3ccccc23)n1)c1cccc2ccccc12 Show InChI InChI=1S/C34H28N4/c1-2-10-25(11-3-1)20-21-30-22-33(35-23-28-16-8-14-26-12-4-6-18-31(26)28)38-34(37-30)36-24-29-17-9-15-27-13-5-7-19-32(27)29/h1-22H,23-24H2,(H2,35,36,37,38)/b21-20+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253349 (CHEMBL492889 | N4-Benzyl-N2-naphthalen-1-ylmethyl-...) Show SMILES C(Nc1cc(\C=C\c2ccccc2)nc(NCc2cccc3ccccc23)n1)c1ccccc1 Show InChI InChI=1S/C30H26N4/c1-3-10-23(11-4-1)18-19-27-20-29(31-21-24-12-5-2-6-13-24)34-30(33-27)32-22-26-16-9-15-25-14-7-8-17-28(25)26/h1-20H,21-22H2,(H2,31,32,33,34)/b19-18+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253421 (CHEMBL524173 | N4-Isobutyl-N2-naphthalen-1-ylmethy...) Show SMILES CC(C)CNc1cc(\C=C\c2ccccc2)nc(NCc2cccc3ccccc23)n1 Show InChI InChI=1S/C27H28N4/c1-20(2)18-28-26-17-24(16-15-21-9-4-3-5-10-21)30-27(31-26)29-19-23-13-8-12-22-11-6-7-14-25(22)23/h3-17,20H,18-19H2,1-2H3,(H2,28,29,30,31)/b16-15+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253420 (CHEMBL493096 | N2-Benzyl-N4-isobutyl-6-styryl-pyri...) Show SMILES CC(C)CNc1cc(\C=C\c2ccccc2)nc(NCc2ccccc2)n1 Show InChI InChI=1S/C23H26N4/c1-18(2)16-24-22-15-21(14-13-19-9-5-3-6-10-19)26-23(27-22)25-17-20-11-7-4-8-12-20/h3-15,18H,16-17H2,1-2H3,(H2,24,25,26,27)/b14-13+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253419 (CHEMBL448274 | Naphthalen-1-ylmethyl-{2-[(naphthal...) Show SMILES CC(C)(C)OC(=O)N(Cc1cccc2ccccc12)c1cc(CCc2ccccc2)nc(NCc2cccc3ccccc23)n1 Show InChI InChI=1S/C39H38N4O2/c1-39(2,3)45-38(44)43(27-32-20-12-18-30-16-8-10-22-35(30)32)36-25-33(24-23-28-13-5-4-6-14-28)41-37(42-36)40-26-31-19-11-17-29-15-7-9-21-34(29)31/h4-22,25H,23-24,26-27H2,1-3H3,(H,40,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253418 (Benzyl-(2-isobutylamino-6-phenethyl-pyrimidin-4-yl...) Show SMILES CC(C)CNc1nc(CCc2ccccc2)cc(n1)N(Cc1ccccc1)C(=O)OC(C)(C)C Show InChI InChI=1S/C28H36N4O2/c1-21(2)19-29-26-30-24(17-16-22-12-8-6-9-13-22)18-25(31-26)32(27(33)34-28(3,4)5)20-23-14-10-7-11-15-23/h6-15,18,21H,16-17,19-20H2,1-5H3,(H,29,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253348 ((2-Benzylamino-6-phenethyl-pyrimidin-4-yl)-isobuty...) Show SMILES CC(C)CN(C(=O)OC(C)(C)C)c1cc(CCc2ccccc2)nc(NCc2ccccc2)n1 Show InChI InChI=1S/C28H36N4O2/c1-21(2)20-32(27(33)34-28(3,4)5)25-18-24(17-16-22-12-8-6-9-13-22)30-26(31-25)29-19-23-14-10-7-11-15-23/h6-15,18,21H,16-17,19-20H2,1-5H3,(H,29,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair
Estrogen receptor (Homo sapiens (Human))	BDBM50253347 (CHEMBL503048 | Naphthalen-1-ylmethyl-{2-[(naphthal...) Show SMILES CC(C)(C)OC(=O)N(Cc1cccc2ccccc12)c1cc(\C=C\c2ccccc2)nc(NCc2cccc3ccccc23)n1 Show InChI InChI=1S/C39H36N4O2/c1-39(2,3)45-38(44)43(27-32-20-12-18-30-16-8-10-22-35(30)32)36-25-33(24-23-28-13-5-4-6-14-28)41-37(42-36)40-26-31-19-11-17-29-15-7-9-21-34(29)31/h4-25H,26-27H2,1-3H3,(H,40,41,42)/b24-23+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity to ERalpha (unknown origin) assessed as inhibition of fluorescein-labeled nuclear receptor domain of steroid receptor coactivator 3 ...				J Med Chem 51: 6512-30 (2008) Article DOI: 10.1021/jm800698b BindingDB Entry DOI: 10.7270/Q2KD1XRF
					More data for this Ligand-Target Pair

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