BDBM50389858 CHEMBL2070868

SMILES: Cc1[nH]c2ccccc2c1C(Nc1ccccc1)c1ccc(CCCO)cc1

InChI Key: InChIKey=KAOODWWVZHYMNZ-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 = 50389858   

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
Vitamin D3 receptor (Homo sapiens (Human))	BDBM50389858 (CHEMBL2070868) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccccc1)c1ccc(CCCO)cc1 Show InChI InChI=1S/C25H26N2O/c1-18-24(22-11-5-6-12-23(22)26-18)25(27-21-9-3-2-4-10-21)20-15-13-19(14-16-20)8-7-17-28/h2-6,9-16,25-28H,7-8,17H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.86E+4	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))	BDBM50389858 (CHEMBL2070868) Show SMILES Cc1[nH]c2ccccc2c1C(Nc1ccccc1)c1ccc(CCCO)cc1 Show InChI InChI=1S/C25H26N2O/c1-18-24(22-11-5-6-12-23(22)26-18)25(27-21-9-3-2-4-10-21)20-15-13-19(14-16-20)8-7-17-28/h2-6,9-16,25-28H,7-8,17H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.31E+4	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