BDBM38606 7-(3,5-dimethoxyanilino)-6-(2-furanylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one::7-(3,5-dimethoxyanilino)-6-(2-furfuryl)-7H-pyrrolo[3,4-b]pyridin-5-one::7-(3,5-dimethoxyanilino)-6-(furan-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one::7-[(3,5-dimethoxyphenyl)amino]-6-(2-furylmethyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one::7-[(3,5-dimethoxyphenyl)amino]-6-(furan-2-ylmethyl)-7H-pyrrolo[3,4-b]pyridin-5-one::MLS000254464::SMR000028156::cid_3241207

SMILES: COc1cc(Nc2n(Cc3ccco3)c(=O)c3ccc[nH]c23)cc(OC)c1

InChI Key: InChIKey=IMJWJBKCBNIYLQ-UHFFFAOYSA-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 = 38606   

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
mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38606 (7-(3,5-dimethoxyanilino)-6-(2-furanylmethyl)-7H-py...) Show SMILES COc1cc(Nc2n(Cc3ccco3)c(=O)c3ccc[nH]c23)cc(OC)c1 Show InChI InChI=1S/C20H19N3O4/c1-25-15-9-13(10-16(11-15)26-2)22-19-18-17(6-3-7-21-18)20(24)23(19)12-14-5-4-8-27-14/h3-11,21-22H,12H2,1-2H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2CF9NG2
					More data for this Ligand-Target Pair
mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38606 (7-(3,5-dimethoxyanilino)-6-(2-furanylmethyl)-7H-py...) Show SMILES COc1cc(Nc2n(Cc3ccco3)c(=O)c3ccc[nH]c23)cc(OC)c1 Show InChI InChI=1S/C20H19N3O4/c1-25-15-9-13(10-16(11-15)26-2)22-19-18-17(6-3-7-21-18)20(24)23(19)12-14-5-4-8-27-14/h3-11,21-22H,12H2,1-2H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	1.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q23X852V
					More data for this Ligand-Target Pair
mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38606 (7-(3,5-dimethoxyanilino)-6-(2-furanylmethyl)-7H-py...) Show SMILES COc1cc(Nc2n(Cc3ccco3)c(=O)c3ccc[nH]c23)cc(OC)c1 Show InChI InChI=1S/C20H19N3O4/c1-25-15-9-13(10-16(11-15)26-2)22-19-18-17(6-3-7-21-18)20(24)23(19)12-14-5-4-8-27-14/h3-11,21-22H,12H2,1-2H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	>1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q27P8WSS
					More data for this Ligand-Target Pair