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SMILES: COc1cc2CCn3c(cc(OCc4cccnc4)nc3=O)-c2cc1OC

InChI Key: InChIKey=VXGKKGMHLPDGHP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 51519   

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
Orotidine 5'-phosphate decarboxylase (Aspergillus niger)	BDBM51519 (9,10-dimethoxy-2-(3-pyridinylmethoxy)-6,7-dihydrop...) Show SMILES COc1cc2CCn3c(cc(OCc4cccnc4)nc3=O)-c2cc1OC Show InChI InChI=1S/C20H19N3O4/c1-25-17-8-14-5-7-23-16(15(14)9-18(17)26-2)10-19(22-20(23)24)27-12-13-4-3-6-21-11-13/h3-4,6,8-11H,5,7,12H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>5.96E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute, TS...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2PK0DN5
					More data for this Ligand-Target Pair
dTDP-4-dehydrorhamnose 3,5-epimerase (Mycobacterium tuberculosis H37Rv)	BDBM51519 (9,10-dimethoxy-2-(3-pyridinylmethoxy)-6,7-dihydrop...) Show SMILES COc1cc2CCn3c(cc(OCc4cccnc4)nc3=O)-c2cc1OC Show InChI InChI=1S/C20H19N3O4/c1-25-17-8-14-5-7-23-16(15(14)9-18(17)26-2)10-19(22-20(23)24)27-12-13-4-3-6-21-11-13/h3-4,6,8-11H,5,7,12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.17E+3	n/a	n/a	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: Michael McNeil, Colorado State Universi...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2TD9VRT
					More data for this Ligand-Target Pair