BDBM49248 4-amino-2-(benzylthio)pyrimidine-5-carboxylic acid ethyl ester::4-amino-2-(phenylmethylthio)-5-pyrimidinecarboxylic acid ethyl ester::MLS000099282::SMR000073548::cid_251641::ethyl 4-amino-2-(benzylthio)-5-pyrimidinecarboxylate::ethyl 4-amino-2-benzylsulfanylpyrimidine-5-carboxylate::ethyl 4-azanyl-2-(phenylmethylsulfanyl)pyrimidine-5-carboxylate

SMILES: CCOC(=O)c1cnc(SCc2ccccc2)nc1N

InChI Key: InChIKey=PMPWPSTVTPCAGQ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 49248   

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
Oxysterols receptor LXR-beta (Homo sapiens (Human))	BDBM49248 (4-amino-2-(benzylthio)pyrimidine-5-carboxylic acid...) Show SMILES CCOC(=O)c1cnc(SCc2ccccc2)nc1N Show InChI InChI=1S/C14H15N3O2S/c1-2-19-13(18)11-8-16-14(17-12(11)15)20-9-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H2,15,16,17)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	n/a	n/a	6.75E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2ZP44SP
					More data for this Ligand-Target Pair
Nuclear factor NF-kappa-B (Homo sapiens (Human))	BDBM49248 (4-amino-2-(benzylthio)pyrimidine-5-carboxylic acid...) Show SMILES CCOC(=O)c1cnc(SCc2ccccc2)nc1N Show InChI InChI=1S/C14H15N3O2S/c1-2-19-13(18)11-8-16-14(17-12(11)15)20-9-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H2,15,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	n/a	n/a	8.92E+3	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q27P8WT7
					More data for this Ligand-Target Pair