BDBM50075175 (E)-4-(3-Nitro-phenyl)-4-oxo-but-2-enoic acid [(S)-1-(5-methyl-4-oxo-4H-thieno[2,3-d][1,3]oxazin-2-yl)-ethyl]-amide::CHEMBL265046

SMILES: C[C@H](NC(=O)\C=C\C(=O)c1cccc(c1)[N+]([O-])=O)c1nc2scc(C)c2c(=O)o1

InChI Key: InChIKey=OPJWYTYZNZHBFS-MLRMMBSGSA-N

Data: 3 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 3 hits for monomerid = 50075175   

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
Human rhinovirus A protease (Human rhinovirus B)	BDBM50075175 ((E)-4-(3-Nitro-phenyl)-4-oxo-but-2-enoic acid [(S)...) Show SMILES C[C@H](NC(=O)\C=C\C(=O)c1cccc(c1)[N+]([O-])=O)c1nc2scc(C)c2c(=O)o1 Show InChI InChI=1S/C19H15N3O6S/c1-10-9-29-18-16(10)19(25)28-17(21-18)11(2)20-15(24)7-6-14(23)12-4-3-5-13(8-12)22(26)27/h3-9,11H,1-2H3,(H,20,24)/b7-6+/t11-/m0/s1	MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity of the compound against varicella zoster virus (VZV) protease				Bioorg Med Chem Lett 9: 449-52 (1999) BindingDB Entry DOI: 10.7270/Q2TM799P
					More data for this Ligand-Target Pair
Human herpesvirus 2 protease (Human herpesvirus 2 (strain HG52) (HHV-2) (Human h...)	BDBM50075175 ((E)-4-(3-Nitro-phenyl)-4-oxo-but-2-enoic acid [(S)...) Show SMILES C[C@H](NC(=O)\C=C\C(=O)c1cccc(c1)[N+]([O-])=O)c1nc2scc(C)c2c(=O)o1 Show InChI InChI=1S/C19H15N3O6S/c1-10-9-29-18-16(10)19(25)28-17(21-18)11(2)20-15(24)7-6-14(23)12-4-3-5-13(8-12)22(26)27/h3-9,11H,1-2H3,(H,20,24)/b7-6+/t11-/m0/s1	MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity against herpes simplex virus protease (HSV-2)				Bioorg Med Chem Lett 9: 449-52 (1999) BindingDB Entry DOI: 10.7270/Q2TM799P
					More data for this Ligand-Target Pair
Human herpes virus 5 capsid protein P40 (Human cytomegalovirus (strain AD169) (HHV-5) (Huma...)	BDBM50075175 ((E)-4-(3-Nitro-phenyl)-4-oxo-but-2-enoic acid [(S)...) Show SMILES C[C@H](NC(=O)\C=C\C(=O)c1cccc(c1)[N+]([O-])=O)c1nc2scc(C)c2c(=O)o1 Show InChI InChI=1S/C19H15N3O6S/c1-10-9-29-18-16(10)19(25)28-17(21-18)11(2)20-15(24)7-6-14(23)12-4-3-5-13(8-12)22(26)27/h3-9,11H,1-2H3,(H,20,24)/b7-6+/t11-/m0/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity against cytomegalovirus protease (CMV)				Bioorg Med Chem Lett 9: 449-52 (1999) BindingDB Entry DOI: 10.7270/Q2TM799P
					More data for this Ligand-Target Pair