null

SMILES: Oc1c(C(c2ccc3Cc4ccccc4-c3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12

InChI Key: InChIKey=VMHSLUQIXCLGPO-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50226820   

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
NAD(P)H dehydrogenase [quinone] 1 (Homo sapiens (Human))	BDBM50226820 (3-((9H-fluoren-3-yl)(4-hydroxy-2-oxo-2H-chromen-3-...) Show SMILES Oc1c(C(c2ccc3Cc4ccccc4-c3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12 Show InChI InChI=1S/C32H20O6/c33-29-21-9-3-5-11-24(21)37-31(35)27(29)26(28-30(34)22-10-4-6-12-25(22)38-32(28)36)19-14-13-18-15-17-7-1-2-8-20(17)23(18)16-19/h1-14,16,26,33-34H,15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO1 in presence of BSA				J Med Chem 50: 6316-25 (2007) Article DOI: 10.1021/jm070472p BindingDB Entry DOI: 10.7270/Q2DV1JM1
					More data for this Ligand-Target Pair
NAD(P)H dehydrogenase [quinone] 1 (Homo sapiens (Human))	BDBM50226820 (3-((9H-fluoren-3-yl)(4-hydroxy-2-oxo-2H-chromen-3-...) Show SMILES Oc1c(C(c2ccc3Cc4ccccc4-c3c2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12 Show InChI InChI=1S/C32H20O6/c33-29-21-9-3-5-11-24(21)37-31(35)27(29)26(28-30(34)22-10-4-6-12-25(22)38-32(28)36)19-14-13-18-15-17-7-1-2-8-20(17)23(18)16-19/h1-14,16,26,33-34H,15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO1				J Med Chem 50: 6316-25 (2007) Article DOI: 10.1021/jm070472p BindingDB Entry DOI: 10.7270/Q2DV1JM1
					More data for this Ligand-Target Pair