BDBM67749 MLS000056716::N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide::N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanamide::N-(5-methyl-3-isoxazolyl)-2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)thio]acetamide::N-(5-methylisoxazol-3-yl)-2-[(2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)thio]acetamide::SMR000065167::cid_2612492

SMILES: Cc1cc(NC(=O)CSc2nc(C)nc3sc4CCCCc4c23)no1

InChI Key: InChIKey=YDIXFXKLOIDVCZ-UHFFFAOYSA-N

Data: 3 IC50  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 5 hits for monomerid = 67749   

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
DNA damage-inducible transcript 3 protein (Mus musculus)	BDBM67749 (MLS000056716 | N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-...) Show SMILES Cc1cc(NC(=O)CSc2nc(C)nc3sc4CCCCc4c23)no1 Show InChI InChI=1S/C17H18N4O2S2/c1-9-7-13(21-23-9)20-14(22)8-24-16-15-11-5-3-4-6-12(11)25-17(15)19-10(2)18-16/h7H,3-6,8H2,1-2H3,(H,20,21,22)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2PC30VZ
					More data for this Ligand-Target Pair
XBP1 (Homo sapiens (Human))	BDBM67749 (MLS000056716 | N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-...) Show SMILES Cc1cc(NC(=O)CSc2nc(C)nc3sc4CCCCc4c23)no1 Show InChI InChI=1S/C17H18N4O2S2/c1-9-7-13(21-23-9)20-14(22)8-24-16-15-11-5-3-4-6-12(11)25-17(15)19-10(2)18-16/h7H,3-6,8H2,1-2H3,(H,20,21,22)	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2NK3CGB
					More data for this Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE (Escherichia coli str. K-12 substr. MG1655)	BDBM67749 (MLS000056716 | N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-...) Show SMILES Cc1cc(NC(=O)CSc2nc(C)nc3sc4CCCCc4c23)no1 Show InChI InChI=1S/C17H18N4O2S2/c1-9-7-13(21-23-9)20-14(22)8-24-16-15-11-5-3-4-6-12(11)25-17(15)19-10(2)18-16/h7H,3-6,8H2,1-2H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>9.90E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2TB15DB
					More data for this Ligand-Target Pair
mRNA interferase toxin, antitoxin is MazE (Escherichia coli str. K-12 substr. MG1655)	BDBM67749 (MLS000056716 | N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-...) Show SMILES Cc1cc(NC(=O)CSc2nc(C)nc3sc4CCCCc4c23)no1 Show InChI InChI=1S/C17H18N4O2S2/c1-9-7-13(21-23-9)20-14(22)8-24-16-15-11-5-3-4-6-12(11)25-17(15)19-10(2)18-16/h7H,3-6,8H2,1-2H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>9.90E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2Z31X54
					More data for this Ligand-Target Pair
DNA damage-inducible transcript 3 protein (Mus musculus)	BDBM67749 (MLS000056716 | N-(5-methyl-1,2-oxazol-3-yl)-2-[(2-...) Show SMILES Cc1cc(NC(=O)CSc2nc(C)nc3sc4CCCCc4c23)no1 Show InChI InChI=1S/C17H18N4O2S2/c1-9-7-13(21-23-9)20-14(22)8-24-16-15-11-5-3-4-6-12(11)25-17(15)19-10(2)18-16/h7H,3-6,8H2,1-2H3,(H,20,21,22)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Dr. Randal Kaufman, Univer...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q28C9TQN
					More data for this Ligand-Target Pair