BDBM75530 MLS001200027::N-(4-chlorophenyl)-4-methyl-2-(methylthio)-5-pyrimidinecarboxamide::N-(4-chlorophenyl)-4-methyl-2-(methylthio)pyrimidine-5-carboxamide::N-(4-chlorophenyl)-4-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide::N-(4-chlorophenyl)-4-methyl-2-methylsulfanylpyrimidine-5-carboxamide::SMR000563752::cid_20899656

SMILES: CSc1ncc(C(=O)Nc2ccc(Cl)cc2)c(C)n1

InChI Key: InChIKey=QQGFMJRWPGIRDB-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 = 75530   

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
Aryl hydrocarbon receptor (Homo sapiens (Human))	BDBM75530 (MLS001200027 | N-(4-chlorophenyl)-4-methyl-2-(meth...) Show SMILES CSc1ncc(C(=O)Nc2ccc(Cl)cc2)c(C)n1 Show InChI InChI=1S/C13H12ClN3OS/c1-8-11(7-15-13(16-8)19-2)12(18)17-10-5-3-9(14)4-6-10/h3-7H,1-2H3,(H,17,18)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	22.2	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 (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2K93612
					More data for this Ligand-Target Pair
Pregnane X receptor (Homo sapiens (Human))	BDBM75530 (MLS001200027 | N-(4-chlorophenyl)-4-methyl-2-(meth...) Show SMILES CSc1ncc(C(=O)Nc2ccc(Cl)cc2)c(C)n1 Show InChI InChI=1S/C13H12ClN3OS/c1-8-11(7-15-13(16-8)19-2)12(18)17-10-5-3-9(14)4-6-10/h3-7H,1-2H3,(H,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>1.16E+5	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 (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2Q23XQJ
					More data for this Ligand-Target Pair