BDBM43490 (E)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fluorophenyl)prop-2-en-1-one::(E)-3-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-(4-fluorophenyl)-2-propen-1-one::(E)-3-[(4,6-dimethylpyrimidin-2-yl)thio]-1-(4-fluorophenyl)prop-2-en-1-one::MLS000851117::SMR000457360::cid_5713207

SMILES: Cc1cc(C)nc(S\C=C\C(=O)c2ccc(F)cc2)n1

InChI Key: InChIKey=IIDUVXPAMLZRAI-BQYQJAHWSA-N

Data: 3 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 3 hits for monomerid = 43490   

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
MDM2-MDMX (Homo sapiens (Human))	BDBM43490 ((E)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fl...) Show SMILES Cc1cc(C)nc(S\C=C\C(=O)c2ccc(F)cc2)n1 Show InChI InChI=1S/C15H13FN2OS/c1-10-9-11(2)18-15(17-10)20-8-7-14(19)12-3-5-13(16)6-4-12/h3-9H,1-2H3/b8-7+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	810	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q21J984Z
					More data for this Ligand-Target Pair
MDM2-MDMX (Homo sapiens (Human))	BDBM43490 ((E)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fl...) Show SMILES Cc1cc(C)nc(S\C=C\C(=O)c2ccc(F)cc2)n1 Show InChI InChI=1S/C15H13FN2OS/c1-10-9-11(2)18-15(17-10)20-8-7-14(19)12-3-5-13(16)6-4-12/h3-9H,1-2H3/b8-7+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	1.24E+3	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2G73C3D
					More data for this Ligand-Target Pair
MDM2-MDMX (Homo sapiens (Human))	BDBM43490 ((E)-3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(4-fl...) Show SMILES Cc1cc(C)nc(S\C=C\C(=O)c2ccc(F)cc2)n1 Show InChI InChI=1S/C15H13FN2OS/c1-10-9-11(2)18-15(17-10)20-8-7-14(19)12-3-5-13(16)6-4-12/h3-9H,1-2H3/b8-7+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	2.67E+3	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2KW5DG0
					More data for this Ligand-Target Pair