BDBM50279698 2-(4-Methyl-2-methylamino-thiazol-5-yl)-3-o-tolyl-3H-quinazolin-4-one::CHEMBL515276

SMILES: CNc1nc(C)c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1C

InChI Key: InChIKey=CNOZEZOCALUISD-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 = 50279698   

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
Transcription factor AP-1 (Homo sapiens (Human))	BDBM50279698 (2-(4-Methyl-2-methylamino-thiazol-5-yl)-3-o-tolyl-...) Show SMILES CNc1nc(C)c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1C |(32.14,-.5,;31.37,.83,;29.84,.83,;29.07,-.51,;27.56,-.19,;26.42,-1.22,;27.4,1.34,;28.8,1.97,;26.07,2.11,;24.72,1.33,;23.38,2.1,;22.04,1.33,;20.71,2.1,;20.71,3.65,;22.04,4.42,;23.38,3.65,;24.71,4.44,;24.7,5.98,;26.06,3.66,;27.39,4.44,;28.73,3.67,;30.06,4.44,;30.05,5.98,;28.71,6.75,;27.38,5.97,;26.05,6.73,)| Show InChI InChI=1S/C20H18N4OS/c1-12-8-4-7-11-16(12)24-18(17-13(2)22-20(21-3)26-17)23-15-10-6-5-9-14(15)19(24)25/h4-11H,1-3H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	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
B.V. Patel Pharmaceutical Education and Research Development Centre Curated by ChEMBL					Assay Description Inhibition of AP1 (unknown origin) expressed in HEK293 cells assessed as inhibition of TNFalpha-induced transcriptional activation treated 24 hrs bef...				Eur J Med Chem 44: 2184-9 (2009) Article DOI: 10.1016/j.ejmech.2008.10.031 BindingDB Entry DOI: 10.7270/Q25X28SV
					More data for this Ligand-Target Pair
Transcription factor AP-1 (Homo sapiens (Human))	BDBM50279698 (2-(4-Methyl-2-methylamino-thiazol-5-yl)-3-o-tolyl-...) Show SMILES CNc1nc(C)c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1C |(32.14,-.5,;31.37,.83,;29.84,.83,;29.07,-.51,;27.56,-.19,;26.42,-1.22,;27.4,1.34,;28.8,1.97,;26.07,2.11,;24.72,1.33,;23.38,2.1,;22.04,1.33,;20.71,2.1,;20.71,3.65,;22.04,4.42,;23.38,3.65,;24.71,4.44,;24.7,5.98,;26.06,3.66,;27.39,4.44,;28.73,3.67,;30.06,4.44,;30.05,5.98,;28.71,6.75,;27.38,5.97,;26.05,6.73,)| Show InChI InChI=1S/C20H18N4OS/c1-12-8-4-7-11-16(12)24-18(17-13(2)22-20(21-3)26-17)23-15-10-6-5-9-14(15)19(24)25/h4-11H,1-3H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	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 Texas Medical Branch Curated by ChEMBL					Assay Description Inhibition of AP-1-mediated transcriptional activation in HEK293 cells by luciferase reporter gene assay				J Med Chem 57: 6930-48 (2014) Article DOI: 10.1021/jm5004733 BindingDB Entry DOI: 10.7270/Q2222WDT
					More data for this Ligand-Target Pair