BDBM50054014 (E)-6-(2-Chloro-6-methoxy-4,5-dimethyl-3-nitro-phenyl)-4-methyl-hex-4-enoic acid::CHEMBL135154

SMILES: COc1c(C)c(C)c(c(Cl)c1C\C=C(/C)CCC(O)=O)[N+]([O-])=O

InChI Key: InChIKey=BVTDVNBVQVSGLW-WEVVVXLNSA-N

Data: 1 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 1 hit for monomerid = 50054014   

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
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2) (Homo sapiens (Human))	BDBM50054014 ((E)-6-(2-Chloro-6-methoxy-4,5-dimethyl-3-nitro-phe...) Show SMILES COc1c(C)c(C)c(c(Cl)c1C\C=C(/C)CCC(O)=O)[N+]([O-])=O Show InChI InChI=1S/C16H20ClNO5/c1-9(6-8-13(19)20)5-7-12-14(17)15(18(21)22)10(2)11(3)16(12)23-4/h5H,6-8H2,1-4H3,(H,19,20)/b9-5+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description Inhibition of human recombinant type II Inosine Monophosphate Dehydrogenase at 100 microM				J Med Chem 39: 4181-96 (1996) Article DOI: 10.1021/jm9603633 BindingDB Entry DOI: 10.7270/Q2668C8Q
					More data for this Ligand-Target Pair