Compile Data Set for Download or QSAR

Found 134 hits with Last Name = 'yuan' and Initial = 'ny'   

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
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446373 (CHEMBL3109624) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(C)c(C)c1)c1ccccc1Cl Show InChI InChI=1S/C24H23ClN2/c1-15-12-13-18(14-16(15)2)27-24(19-8-4-6-10-21(19)25)23-17(3)26-22-11-7-5-9-20(22)23/h4-14,24,26-27H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446350 (CHEMBL3109604) Show SMILES COc1ccc(cc1)C(Nc1ccc(cc1)C(F)(F)F)c1c(C)[nH]c2ccccc12 Show InChI InChI=1S/C24H21F3N2O/c1-15-22(20-5-3-4-6-21(20)28-15)23(16-7-13-19(30-2)14-8-16)29-18-11-9-17(10-12-18)24(25,26)27/h3-14,23,28-29H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389887 (CHEMBL2070841) Show SMILES CCCS(=O)(=O)c1oc(nc1S(=O)(=O)c1ccc(F)cc1)-c1cccs1 Show InChI InChI=1S/C16H14FNO5S3/c1-2-10-25(19,20)16-15(18-14(23-16)13-4-3-9-24-13)26(21,22)12-7-5-11(17)6-8-12/h3-9H,2,10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM60445 ((6-piperidinosulfonyl-1,3-benzothiazol-2-yl)amine ...) Show SMILES Nc1nc2ccc(cc2s1)S(=O)(=O)N1CCCCC1 Show InChI InChI=1S/C12H15N3O2S2/c13-12-14-10-5-4-9(8-11(10)18-12)19(16,17)15-6-2-1-3-7-15/h4-5,8H,1-3,6-7H2,(H2,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446371 (CHEMBL3109597) Show SMILES COc1ccc(NC(c2c(C)[nH]c3ccccc23)c2ccc(OC(F)(F)F)cc2)cc1OC Show InChI InChI=1S/C25H23F3N2O3/c1-15-23(19-6-4-5-7-20(19)29-15)24(16-8-11-18(12-9-16)33-25(26,27)28)30-17-10-13-21(31-2)22(14-17)32-3/h4-14,24,29-30H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389883 (CHEMBL2070844) Show SMILES CC(C)S(=O)(=O)c1oc(nc1S(=O)(=O)c1ccccc1)-c1cccs1 Show InChI InChI=1S/C16H15NO5S3/c1-11(2)24(18,19)16-15(17-14(22-16)13-9-6-10-23-13)25(20,21)12-7-4-3-5-8-12/h3-11H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446372 (CHEMBL3109596) Show SMILES COc1ccc(NC(c2c(C)[nH]c3ccccc23)c2ccccc2Cl)cc1OC Show InChI InChI=1S/C24H23ClN2O2/c1-15-23(18-9-5-7-11-20(18)26-15)24(17-8-4-6-10-19(17)25)27-16-12-13-21(28-2)22(14-16)29-3/h4-14,24,26-27H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446369 (CHEMBL3108789) Show SMILES COc1ccc(cc1)C(Nc1ccc(OC)c(OC)c1)c1c(C)[nH]c2ccccc12 Show InChI InChI=1S/C25H26N2O3/c1-16-24(20-7-5-6-8-21(20)26-16)25(17-9-12-19(28-2)13-10-17)27-18-11-14-22(29-3)23(15-18)30-4/h5-15,25-27H,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446361 (CHEMBL3109609) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(Cl)cc1)c1cccnc1 Show InChI InChI=1S/C21H18ClN3/c1-14-20(18-6-2-3-7-19(18)24-14)21(15-5-4-12-23-13-15)25-17-10-8-16(22)9-11-17/h2-13,21,24-25H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389891 (CHEMBL2070859) Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)cc1)=[N+]2C |c:25| Show InChI InChI=1S/C22H24NO3/c1-22(2)18-14-16(21(24)26-5)9-12-19(18)23(3)20(22)13-8-15-6-10-17(25-4)11-7-15/h6-14H,1-5H3/q+1/b13-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446362 (CHEMBL3109608) Show SMILES Cc1[nH]c2cc(C)ccc2c1C(NCc1ccc(C)cc1)c1ccccc1Cl Show InChI InChI=1S/C25H25ClN2/c1-16-8-11-19(12-9-16)15-27-25(20-6-4-5-7-22(20)26)24-18(3)28-23-14-17(2)10-13-21(23)24/h4-14,25,27-28H,15H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446360 (CHEMBL3109610) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(Cl)cc1)c1ccncc1 Show InChI InChI=1S/C21H18ClN3/c1-14-20(18-4-2-3-5-19(18)24-14)21(15-10-12-23-13-11-15)25-17-8-6-16(22)7-9-17/h2-13,21,24-25H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446357 (CHEMBL3109614) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(Cl)cc1)c1nccs1 Show InChI InChI=1S/C19H16ClN3S/c1-12-17(15-4-2-3-5-16(15)22-12)18(19-21-10-11-24-19)23-14-8-6-13(20)7-9-14/h2-11,18,22-23H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389892 (CHEMBL2070858) Show SMILES COc1ccc(\C=C\C2=[N+](C)c3ccc(OC)cc3C2(C)C)cc1 |c:8| Show InChI InChI=1S/C21H24NO2/c1-21(2)18-14-17(24-5)11-12-19(18)22(3)20(21)13-8-15-6-9-16(23-4)10-7-15/h6-14H,1-5H3/q+1/b13-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389856 (CHEMBL2070870) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(Cl)cc1)c1ccccc1Cl Show InChI InChI=1S/C22H18Cl2N2/c1-14-21(18-7-3-5-9-20(18)25-14)22(17-6-2-4-8-19(17)24)26-16-12-10-15(23)11-13-16/h2-13,22,25-26H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446370 (CHEMBL3109598) Show SMILES COc1ccc(NC(c2c(C)[nH]c3ccccc23)c2ccc(cc2)C(F)(F)F)cc1OC Show InChI InChI=1S/C25H23F3N2O2/c1-15-23(19-6-4-5-7-20(19)29-15)24(16-8-10-17(11-9-16)25(26,27)28)30-18-12-13-21(31-2)22(14-18)32-3/h4-14,24,29-30H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389852 (CHEMBL2070874) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(cc1)[N+]([O-])=O)c1ccccc1Cl Show InChI InChI=1S/C22H18ClN3O2/c1-14-21(18-7-3-5-9-20(18)24-14)22(17-6-2-4-8-19(17)23)25-15-10-12-16(13-11-15)26(27)28/h2-13,22,24-25H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446348 (CHEMBL3109600) Show SMILES Cc1[nH]c2cc(C)ccc2c1C(Nc1ccc(OC(F)(F)F)cc1)c1ccccc1Cl Show InChI InChI=1S/C24H20ClF3N2O/c1-14-7-12-19-21(13-14)29-15(2)22(19)23(18-5-3-4-6-20(18)25)30-16-8-10-17(11-9-16)31-24(26,27)28/h3-13,23,29-30H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446368 (CHEMBL3109601) Show SMILES Cc1[nH]c2cc(C)ccc2c1C(Nc1ccc(Cl)cc1)c1ccccc1Cl Show InChI InChI=1S/C23H20Cl2N2/c1-14-7-12-19-21(13-14)26-15(2)22(19)23(18-5-3-4-6-20(18)25)27-17-10-8-16(24)9-11-17/h3-13,23,26-27H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389886 (CHEMBL2070842) Show SMILES CCS(=O)(=O)c1oc(nc1S(=O)(=O)c1ccccc1)-c1cccs1 Show InChI InChI=1S/C15H13NO5S3/c1-2-23(17,18)15-14(16-13(21-15)12-9-6-10-22-12)24(19,20)11-7-4-3-5-8-11/h3-10H,2H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446351 (CHEMBL3109622) Show SMILES COc1ncccc1NC(c1c(C)[nH]c2cc(C)ccc12)c1cccnc1 Show InChI InChI=1S/C22H22N4O/c1-14-8-9-17-19(12-14)25-15(2)20(17)21(16-6-4-10-23-13-16)26-18-7-5-11-24-22(18)27-3/h4-13,21,25-26H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446365 (CHEMBL3109605) Show SMILES Cc1[nH]c2ccccc2c1C(NCc1ccccc1)c1ccccc1Cl Show InChI InChI=1S/C23H21ClN2/c1-16-22(19-12-6-8-14-21(19)26-16)23(18-11-5-7-13-20(18)24)25-15-17-9-3-2-4-10-17/h2-14,23,25-26H,15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389892 (CHEMBL2070858) Show SMILES COc1ccc(\C=C\C2=[N+](C)c3ccc(OC)cc3C2(C)C)cc1 |c:8| Show InChI InChI=1S/C21H24NO2/c1-21(2)18-14-17(24-5)11-12-19(18)22(3)20(21)13-8-15-6-9-16(23-4)10-7-15/h6-14H,1-5H3/q+1/b13-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389890 (CHEMBL2070839) Show SMILES CCOc1ccc(\C=C\C2=[N+](C)c3ccc(cc3C2(C)C)C(=O)OC)cc1 |c:9| Show InChI InChI=1S/C23H26NO3/c1-6-27-18-11-7-16(8-12-18)9-14-21-23(2,3)19-15-17(22(25)26-5)10-13-20(19)24(21)4/h7-15H,6H2,1-5H3/q+1/b14-9+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446364 (CHEMBL3109606) Show SMILES Cc1[nH]c2cc(C)ccc2c1C(NCc1ccccc1)c1ccccc1Cl Show InChI InChI=1S/C24H23ClN2/c1-16-12-13-20-22(14-16)27-17(2)23(20)24(19-10-6-7-11-21(19)25)26-15-18-8-4-3-5-9-18/h3-14,24,26-27H,15H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389854 (CHEMBL2070871) Show SMILES COc1ccc(NC(c2c(C)[nH]c3ccccc23)c2ccccc2Cl)cc1 Show InChI InChI=1S/C23H21ClN2O/c1-15-22(19-8-4-6-10-21(19)25-15)23(18-7-3-5-9-20(18)24)26-16-11-13-17(27-2)14-12-16/h3-14,23,25-26H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446366 (CHEMBL3109603) Show SMILES Cc1[nH]c2cc(C)ccc2c1C(Nc1ccc(cc1)C(F)(F)F)c1ccccc1Cl Show InChI InChI=1S/C24H20ClF3N2/c1-14-7-12-19-21(13-14)29-15(2)22(19)23(18-5-3-4-6-20(18)25)30-17-10-8-16(9-11-17)24(26,27)28/h3-13,23,29-30H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389890 (CHEMBL2070839) Show SMILES CCOc1ccc(\C=C\C2=[N+](C)c3ccc(cc3C2(C)C)C(=O)OC)cc1 |c:9| Show InChI InChI=1S/C23H26NO3/c1-6-27-18-11-7-16(8-12-18)9-14-21-23(2,3)19-15-17(22(25)26-5)10-13-20(19)24(21)4/h7-15H,6H2,1-5H3/q+1/b14-9+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389891 (CHEMBL2070859) Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(OC)cc1)=[N+]2C |c:25| Show InChI InChI=1S/C22H24NO3/c1-22(2)18-14-16(21(24)26-5)9-12-19(18)23(3)20(22)13-8-15-6-10-17(25-4)11-7-15/h6-14H,1-5H3/q+1/b13-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446358 (CHEMBL3109613) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(Cl)cc1)c1ncc[nH]1 Show InChI InChI=1S/C19H17ClN4/c1-12-17(15-4-2-3-5-16(15)23-12)18(19-21-10-11-22-19)24-14-8-6-13(20)7-9-14/h2-11,18,23-24H,1H3,(H,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389885 (CHEMBL2070843) Show SMILES CC(C)CS(=O)(=O)c1oc(nc1S(=O)(=O)c1ccc(F)cc1)-c1cccs1 Show InChI InChI=1S/C17H16FNO5S3/c1-11(2)10-26(20,21)17-16(19-15(24-17)14-4-3-9-25-14)27(22,23)13-7-5-12(18)6-8-13/h3-9,11H,10H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446353 (CHEMBL3109620) Show SMILES Cc1[nH]c2cc(C)ccc2c1C(Nc1cccnc1)c1ccccc1Cl Show InChI InChI=1S/C22H20ClN3/c1-14-9-10-18-20(12-14)25-15(2)21(18)22(17-7-3-4-8-19(17)23)26-16-6-5-11-24-13-16/h3-13,22,25-26H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM34717 (2-[(E)-2-(4-hydroxyphenyl)ethenyl]-1,3,3-trimethyl...) Show SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(\C=C\c1ccc(O)cc1)=[N+]2C |c:24| Show InChI InChI=1S/C21H21NO3/c1-21(2)17-13-15(20(24)25-4)8-11-18(17)22(3)19(21)12-7-14-5-9-16(23)10-6-14/h5-13H,1-4H3/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389885 (CHEMBL2070843) Show SMILES CC(C)CS(=O)(=O)c1oc(nc1S(=O)(=O)c1ccc(F)cc1)-c1cccs1 Show InChI InChI=1S/C17H16FNO5S3/c1-11(2)10-26(20,21)17-16(19-15(24-17)14-4-3-9-25-14)27(22,23)13-7-5-12(18)6-8-13/h3-9,11H,10H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389887 (CHEMBL2070841) Show SMILES CCCS(=O)(=O)c1oc(nc1S(=O)(=O)c1ccc(F)cc1)-c1cccs1 Show InChI InChI=1S/C16H14FNO5S3/c1-2-10-25(19,20)16-15(18-14(23-16)13-4-3-9-24-13)26(21,22)12-7-5-11(17)6-8-12/h3-9H,2,10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446365 (CHEMBL3109605) Show SMILES Cc1[nH]c2ccccc2c1C(NCc1ccccc1)c1ccccc1Cl Show InChI InChI=1S/C23H21ClN2/c1-16-22(19-12-6-8-14-21(19)26-16)23(18-11-5-7-13-20(18)24)25-15-17-9-3-2-4-10-17/h2-14,23,25-26H,15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD (unknown origin)-SRC2-3 interaction after 2 hrs by fluorescence polarization assay				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446372 (CHEMBL3109596) Show SMILES COc1ccc(NC(c2c(C)[nH]c3ccccc23)c2ccccc2Cl)cc1OC Show InChI InChI=1S/C24H23ClN2O2/c1-15-23(18-9-5-7-11-20(18)26-15)24(17-8-4-6-10-19(17)25)27-16-12-13-21(28-2)22(14-16)29-3/h4-14,24,26-27H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD (unknown origin)-SRC2-3 interaction after 2 hrs by fluorescence polarization assay				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446367 (CHEMBL3109602) Show SMILES COc1ccc2c(C(Nc3ccc(Cl)cc3)c3ccccc3Cl)c(C)[nH]c2c1 Show InChI InChI=1S/C23H20Cl2N2O/c1-14-22(19-12-11-17(28-2)13-21(19)26-14)23(18-5-3-4-6-20(18)25)27-16-9-7-15(24)8-10-16/h3-13,23,26-27H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389886 (CHEMBL2070842) Show SMILES CCS(=O)(=O)c1oc(nc1S(=O)(=O)c1ccccc1)-c1cccs1 Show InChI InChI=1S/C15H13NO5S3/c1-2-23(17,18)15-14(16-13(21-15)12-9-6-10-22-12)24(19,20)11-7-4-3-5-8-11/h3-10H,2H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389864 (CHEMBL2070861) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccccc1)c1ccc(Cl)cc1 Show InChI InChI=1S/C22H19ClN2/c1-15-21(19-9-5-6-10-20(19)24-15)22(16-11-13-17(23)14-12-16)25-18-7-3-2-4-8-18/h2-14,22,24-25H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446350 (CHEMBL3109604) Show SMILES COc1ccc(cc1)C(Nc1ccc(cc1)C(F)(F)F)c1c(C)[nH]c2ccccc12 Show InChI InChI=1S/C24H21F3N2O/c1-15-22(20-5-3-4-6-21(20)28-15)23(16-7-13-19(30-2)14-8-16)29-18-11-9-17(10-12-18)24(25,26)27/h3-14,23,28-29H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR-LBD (unknown origin)-mediated GAL4-labeled SRC1 transcription expressed in HEK293T cells after 16 hrs by two-hy...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389855 (CHEMBL2070872) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccc(C)cc1)c1ccccc1Cl Show InChI InChI=1S/C23H21ClN2/c1-15-11-13-17(14-12-15)26-23(18-7-3-5-9-20(18)24)22-16(2)25-21-10-6-4-8-19(21)22/h3-14,23,25-26H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446352 (CHEMBL3109621) Show SMILES COc1ccc(NC(c2nccs2)c2c(C)[nH]c3ccccc23)cc1OC Show InChI InChI=1S/C21H21N3O2S/c1-13-19(15-6-4-5-7-16(15)23-13)20(21-22-10-11-27-21)24-14-8-9-17(25-2)18(12-14)26-3/h4-12,20,23-24H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389857 (CHEMBL2070869) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccccc1)c1ccccc1Cl Show InChI InChI=1S/C22H19ClN2/c1-15-21(18-12-6-8-14-20(18)24-15)22(17-11-5-7-13-19(17)23)25-16-9-3-2-4-10-16/h2-14,22,24-25H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389888 (CHEMBL2070840) Show SMILES COC(=O)c1ccc(\C=C\C2=[N+](C)c3ccc(OC)cc3C2(C)C)cc1 |c:10| Show InChI InChI=1S/C22H24NO3/c1-22(2)18-14-17(25-4)11-12-19(18)23(3)20(22)13-8-15-6-9-16(10-7-15)21(24)26-5/h6-14H,1-5H3/q+1/b13-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of LG190178-induced VDR-LBD interaction to Alexa Fluor 647-labeled SRC2-3 after 3 hrs by fluorescence polarization assay				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389851 (CHEMBL2070876) Show SMILES COc1ccccc1NC(c1c(C)[nH]c2ccccc12)c1ccccc1Cl Show InChI InChI=1S/C23H21ClN2O/c1-15-22(17-10-4-6-12-19(17)25-15)23(16-9-3-5-11-18(16)24)26-20-13-7-8-14-21(20)27-2/h3-14,23,25-26H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389853 (CHEMBL2070873) Show SMILES CN(C)c1ccc(NC(c2c(C)[nH]c3ccccc23)c2ccccc2Cl)cc1 Show InChI InChI=1S/C24H24ClN3/c1-16-23(20-9-5-7-11-22(20)26-16)24(19-8-4-6-10-21(19)25)27-17-12-14-18(15-13-17)28(2)3/h4-15,24,26-27H,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of CMV-VDR expressed in human HEK293T cells assessed as inhibition of 1,25-(OH)2D3-induced CYP24A1 promoter transcription after 16 hrs by ...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446363 (CHEMBL3109607) Show SMILES Cc1[nH]c2cc(C)ccc2c1C(NCc1ccc(cc1)C(F)(F)F)c1ccccc1Cl Show InChI InChI=1S/C25H22ClF3N2/c1-15-7-12-20-22(13-15)31-16(2)23(20)24(19-5-3-4-6-21(19)26)30-14-17-8-10-18(11-9-17)25(27,28)29/h3-13,24,30-31H,14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389878 (CHEMBL2070850) Show SMILES CC(C)c1ccc(cc1)C(Nc1ccccn1)c1c(C)[nH]c2ccccc12 Show InChI InChI=1S/C24H25N3/c1-16(2)18-11-13-19(14-12-18)24(27-22-10-6-7-15-25-22)23-17(3)26-21-9-5-4-8-20(21)23/h4-16,24,26H,1-3H3,(H,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of VDR-LBD expressed in human HEK293T cells co-expressing GAL4-DBD assessed as inhibition of 1,25-(OH)2D3-induced transcription after 24 h...				J Med Chem 55: 4640-51 (2012) Article DOI: 10.1021/jm300460c BindingDB Entry DOI: 10.7270/Q2HD7WRP
					More data for this Ligand-Target Pair
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50446349 (CHEMBL3109599) Show SMILES COc1ccc(NC(c2c(C)[nH]c3cc(C)ccc23)c2ccccc2Cl)cc1OC Show InChI InChI=1S/C25H25ClN2O2/c1-15-9-11-19-21(13-15)27-16(2)24(19)25(18-7-5-6-8-20(18)26)28-17-10-12-22(29-3)23(14-17)30-4/h5-14,25,27-28H,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Milwaukee Curated by ChEMBL					Assay Description Inhibition of 1,25(OH)2D3-induced VDR (unknown origin)-mediated CYP24A1 transcription expressed in HEK293T cells after 16 hrs by luciferase reporter ...				ACS Med Chem Lett 5: 199-204 (2014) Article DOI: 10.1021/ml400462j BindingDB Entry DOI: 10.7270/Q2KK9D8Q
					More data for this Ligand-Target Pair

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