Compile Data Set for Download or QSAR

Found 80 hits with Last Name = 'kadirvel' and Initial = 'm'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515994 (CHEMBL4514167) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3cccnc3)c2c1 Show InChI InChI=1S/C17H16N4O/c1-12-8-17(21-19-11-13-4-3-7-18-10-13)15-9-14(22-2)5-6-16(15)20-12/h3-11H,1-2H3,(H,20,21)/b19-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515978 (CHEMBL1967497) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3cccc(OC)c3O)c2c1 Show InChI InChI=1S/C19H19N3O3/c1-12-9-17(15-10-14(24-2)7-8-16(15)21-12)22-20-11-13-5-4-6-18(25-3)19(13)23/h4-11,23H,1-3H3,(H,21,22)/b20-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150963 (CHEMBL3770674) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C17H13N3O3.C2H4O2/c18-17(19)12-6-4-11(5-7-12)15-8-9-16(23-15)13-2-1-3-14(10-13)20(21)22;1-2(3)4/h1-10H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150962 (CHEMBL3770366) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C17H13N3O3.C2H4O2/c18-17(19)13-3-1-11(2-4-13)15-9-10-16(23-15)12-5-7-14(8-6-12)20(21)22;1-2(3)4/h1-10H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515995 (CHEMBL4435240) Show SMILES COc1ccc2nc(C)cc(N\N=C\Cc3ccccc3)c2c1 Show InChI InChI=1S/C19H19N3O/c1-14-12-19(17-13-16(23-2)8-9-18(17)21-14)22-20-11-10-15-6-4-3-5-7-15/h3-9,11-13H,10H2,1-2H3,(H,21,22)/b20-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515985 (CHEMBL1237241 | TCMDC-142036) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3ccc(o3)[N+]([O-])=O)c2c1 Show InChI InChI=1S/C16H14N4O4/c1-10-7-15(13-8-11(23-2)3-5-14(13)18-10)19-17-9-12-4-6-16(24-12)20(21)22/h3-9H,1-2H3,(H,18,19)/b17-9+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150962 (CHEMBL3770366) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C17H13N3O3.C2H4O2/c18-17(19)13-3-1-11(2-4-13)15-9-10-16(23-15)12-5-7-14(8-6-12)20(21)22;1-2(3)4/h1-10H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151002 (CHEMBL3770215) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(Br)cc1 Show InChI InChI=1S/C17H13BrN2O.C2H4O2/c18-14-7-5-12(6-8-14)16-10-9-15(21-16)11-1-3-13(4-2-11)17(19)20;1-2(3)4/h1-10H,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150963 (CHEMBL3770674) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C17H13N3O3.C2H4O2/c18-17(19)12-6-4-11(5-7-12)15-8-9-16(23-15)13-2-1-3-14(10-13)20(21)22;1-2(3)4/h1-10H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50388602 (FURAMIDINE) Show SMILES NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N |w:1.0,20.23| Show InChI InChI=1S/C18H16N4O/c19-17(20)13-5-1-11(2-6-13)15-9-10-16(23-15)12-3-7-14(8-4-12)18(21)22/h1-10H,(H3,19,20)(H3,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE MMDB PC cid PC sid UniChem	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 assessed as change in rate of decolouration of DCPIP measured over 1 min by spectrophotometric method				Bioorg Med Chem Lett 28: 1292-1297 (2018) Article DOI: 10.1016/j.bmcl.2018.03.025 BindingDB Entry DOI: 10.7270/Q2154KP5
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50388602 (FURAMIDINE) Show SMILES NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N |w:1.0,20.23| Show InChI InChI=1S/C18H16N4O/c19-17(20)13-5-1-11(2-6-13)15-9-10-16(23-15)12-3-7-14(8-4-12)18(21)22/h1-10H,(H3,19,20)(H3,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE MMDB PC cid PC sid UniChem	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515977 (CHEMBL4463549) Show SMILES NCCNC(=O)c1cc(cc2ccc(nc12)-c1ccccc1)[N+]([O-])=O Show InChI InChI=1S/C18H16N4O3/c19-8-9-20-18(23)15-11-14(22(24)25)10-13-6-7-16(21-17(13)15)12-4-2-1-3-5-12/h1-7,10-11H,8-9,19H2,(H,20,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli BL21 (DE3) using DCPIP as substrate				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515984 (CHEMBL4558270) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3cc(O)cc(O)c3)c2c1 Show InChI InChI=1S/C18H17N3O3/c1-11-5-18(16-9-15(24-2)3-4-17(16)20-11)21-19-10-12-6-13(22)8-14(23)7-12/h3-10,22-23H,1-2H3,(H,20,21)/b19-10+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151029 (CHEMBL3770283) Show SMILES Cc1c(C)c(oc1-c1ccc(cc1)C(N)=N)-c1ccc(cc1)C(N)=N Show InChI InChI=1S/C20H20N4O/c1-11-12(2)18(14-5-9-16(10-6-14)20(23)24)25-17(11)13-3-7-15(8-4-13)19(21)22/h3-10H,1-2H3,(H3,21,22)(H3,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIP as substrate and NRH as cofactor in absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515979 (CHEMBL4436961) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3ccc(O)cc3)c2c1 Show InChI InChI=1S/C18H17N3O2/c1-12-9-18(16-10-15(23-2)7-8-17(16)20-12)21-19-11-13-3-5-14(22)6-4-13/h3-11,22H,1-2H3,(H,20,21)/b19-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of NQO2 in human SKOV3 cells assessed as reduction in cell viability in presence of 1 uM CB1954 and EPR incubated for 24 hrs measured afte...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515979 (CHEMBL4436961) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3ccc(O)cc3)c2c1 Show InChI InChI=1S/C18H17N3O2/c1-12-9-18(16-10-15(23-2)7-8-17(16)20-12)21-19-11-13-3-5-14(22)6-4-13/h3-11,22H,1-2H3,(H,20,21)/b19-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515976 (CHEMBL4534563) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3ccc(cc3)C(O)=O)c2c1 Show InChI InChI=1S/C19H17N3O3/c1-12-9-18(16-10-15(25-2)7-8-17(16)21-12)22-20-11-13-3-5-14(6-4-13)19(23)24/h3-11H,1-2H3,(H,21,22)(H,23,24)/b20-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151024 (CHEMBL3769837) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccccc1 Show InChI InChI=1S/C17H14N2O.C2H4O2/c18-17(19)14-8-6-13(7-9-14)16-11-10-15(20-16)12-4-2-1-3-5-12;1-2(3)4/h1-11H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50461058 (CHEMBL3771399) Show SMILES NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccccc1 Show InChI InChI=1S/C17H14N2O/c18-17(19)14-8-6-13(7-9-14)16-11-10-15(20-16)12-4-2-1-3-5-12/h1-11H,(H3,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 assessed as change in rate of decolouration of DCPIP measured over 1 min by spectrophotometric method				Bioorg Med Chem Lett 28: 1292-1297 (2018) Article DOI: 10.1016/j.bmcl.2018.03.025 BindingDB Entry DOI: 10.7270/Q2154KP5
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50516001 (CHEMBL4443539) Show SMILES NCCNC(=O)c1cccc2nc(ccc12)-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H21N3O/c25-15-16-26-24(28)21-7-4-8-23-20(21)13-14-22(27-23)19-11-9-18(10-12-19)17-5-2-1-3-6-17/h1-14H,15-16,25H2,(H,26,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli BL21 (DE3) using DCPIP as substrate				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515986 (CHEMBL4553527) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3c[nH]cn3)c2c1 Show InChI InChI=1S/C15H15N5O/c1-10-5-15(20-18-8-11-7-16-9-17-11)13-6-12(21-2)3-4-14(13)19-10/h3-9H,1-2H3,(H,16,17)(H,19,20)/b18-8+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50388602 (FURAMIDINE) Show SMILES NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N |w:1.0,20.23| Show InChI InChI=1S/C18H16N4O/c19-17(20)13-5-1-11(2-6-13)15-9-10-16(23-15)12-3-7-14(8-4-12)18(21)22/h1-10H,(H3,19,20)(H3,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE MMDB PC cid PC sid UniChem	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150978 (CHEMBL3770187) Show SMILES CC(O)=O.Cc1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N Show InChI InChI=1S/C18H16N2O.C2H4O2/c1-12-2-4-13(5-3-12)16-10-11-17(21-16)14-6-8-15(9-7-14)18(19)20;1-2(3)4/h2-11H,1H3,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50388064 (CHEMBL1237284 | TCMDC-123970) Show SMILES COc1ccc2nc(C)cc(N=NCc3ccc(cc3)[N+]([O-])=O)c2c1 |w:11.10| Show InChI InChI=1S/C18H16N4O3/c1-12-9-18(16-10-15(25-2)7-8-17(16)20-12)21-19-11-13-3-5-14(6-4-13)22(23)24/h3-10H,11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515975 (CHEMBL4443793) Show SMILES COc1ccc2nc(cc(N\N=C\c3c[nH]cn3)c2c1)-c1ccccc1 Show InChI InChI=1S/C20H17N5O/c1-26-16-7-8-18-17(9-16)20(25-23-12-15-11-21-13-22-15)10-19(24-18)14-5-3-2-4-6-14/h2-13H,1H3,(H,21,22)(H,24,25)/b23-12+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151020 (CHEMBL3769656) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1cccc(F)c1 Show InChI InChI=1S/C17H13FN2O.C2H4O2/c18-14-3-1-2-13(10-14)16-9-8-15(21-16)11-4-6-12(7-5-11)17(19)20;1-2(3)4/h1-10H,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515987 (CHEMBL3197908) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3ccc(F)cc3)c2c1 Show InChI InChI=1S/C18H16FN3O/c1-12-9-18(16-10-15(23-2)7-8-17(16)21-12)22-20-11-13-3-5-14(19)6-4-13/h3-11H,1-2H3,(H,21,22)/b20-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150982 (CHEMBL3770021) Show SMILES CC(O)=O.COc1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N Show InChI InChI=1S/C18H16N2O2.C2H4O2/c1-21-15-8-6-13(7-9-15)17-11-10-16(22-17)12-2-4-14(5-3-12)18(19)20;1-2(3)4/h2-11H,1H3,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	107	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150978 (CHEMBL3770187) Show SMILES CC(O)=O.Cc1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N Show InChI InChI=1S/C18H16N2O.C2H4O2/c1-12-2-4-13(5-3-12)16-10-11-17(21-16)14-6-8-15(9-7-14)18(19)20;1-2(3)4/h2-11H,1H3,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151020 (CHEMBL3769656) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1cccc(F)c1 Show InChI InChI=1S/C17H13FN2O.C2H4O2/c18-14-3-1-2-13(10-14)16-9-8-15(21-16)11-4-6-12(7-5-11)17(19)20;1-2(3)4/h1-10H,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	111	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515981 (CHEMBL4538465) Show SMILES COc1ccc2nc(cc(N\N=C\Cc3ccccc3)c2c1)-c1ccccc1 Show InChI InChI=1S/C24H21N3O/c1-28-20-12-13-22-21(16-20)24(17-23(26-22)19-10-6-3-7-11-19)27-25-15-14-18-8-4-2-5-9-18/h2-13,15-17H,14H2,1H3,(H,26,27)/b25-15+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	125	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515997 (CHEMBL4467366) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3cccc(O)c3)c2c1 Show InChI InChI=1S/C18H17N3O2/c1-12-8-18(16-10-15(23-2)6-7-17(16)20-12)21-19-11-13-4-3-5-14(22)9-13/h3-11,22H,1-2H3,(H,20,21)/b19-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	137	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151024 (CHEMBL3769837) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccccc1 Show InChI InChI=1S/C17H14N2O.C2H4O2/c18-17(19)14-8-6-13(7-9-14)16-11-10-15(20-16)12-4-2-1-3-5-12;1-2(3)4/h1-11H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	139	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151024 (CHEMBL3769837) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccccc1 Show InChI InChI=1S/C17H14N2O.C2H4O2/c18-17(19)14-8-6-13(7-9-14)16-11-10-15(20-16)12-4-2-1-3-5-12;1-2(3)4/h1-11H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIP as substrate and NRH as cofactor in absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150982 (CHEMBL3770021) Show SMILES CC(O)=O.COc1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N Show InChI InChI=1S/C18H16N2O2.C2H4O2/c1-21-15-8-6-13(7-9-15)17-11-10-16(22-17)12-2-4-14(5-3-12)18(19)20;1-2(3)4/h2-11H,1H3,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	141	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515999 (CHEMBL2008533) Show SMILES Cc1cc(NCCCCCCCCNc2cc(C)nc3cc(N)ccc23)c2ccc(N)cc2n1 Show InChI InChI=1S/C28H36N6/c1-19-15-25(23-11-9-21(29)17-27(23)33-19)31-13-7-5-3-4-6-8-14-32-26-16-20(2)34-28-18-22(30)10-12-24(26)28/h9-12,15-18H,3-8,13-14,29-30H2,1-2H3,(H,31,33)(H,32,34)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli BL21 (DE3) using DCPIP as substrate				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151002 (CHEMBL3770215) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(Br)cc1 Show InChI InChI=1S/C17H13BrN2O.C2H4O2/c18-14-7-5-12(6-8-14)16-10-9-15(21-16)11-1-3-13(4-2-11)17(19)20;1-2(3)4/h1-10H,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	185	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150965 (CHEMBL3771261) Show SMILES CC(O)=O.CCc1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N Show InChI InChI=1S/C19H18N2O.C2H4O2/c1-2-13-3-5-14(6-4-13)17-11-12-18(22-17)15-7-9-16(10-8-15)19(20)21;1-2(3)4/h3-12H,2H2,1H3,(H3,20,21);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	202	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515989 (CHEMBL1980272 | NSC-273829) Show SMILES Cc1cc(NCCCCCCCNc2cc(C)nc3cc(N)ccc23)c2ccc(N)cc2n1 Show InChI InChI=1S/C27H34N6/c1-18-14-24(22-10-8-20(28)16-26(22)32-18)30-12-6-4-3-5-7-13-31-25-15-19(2)33-27-17-21(29)9-11-23(25)27/h8-11,14-17H,3-7,12-13,28-29H2,1-2H3,(H,30,32)(H,31,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli BL21 (DE3) using DCPIP as substrate				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150965 (CHEMBL3771261) Show SMILES CC(O)=O.CCc1ccc(cc1)-c1ccc(o1)-c1ccc(cc1)C(N)=N Show InChI InChI=1S/C19H18N2O.C2H4O2/c1-2-13-3-5-14(6-4-13)17-11-12-18(22-17)15-7-9-16(10-8-15)19(20)21;1-2(3)4/h3-12H,2H2,1H3,(H3,20,21);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	312	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the prsence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150961 (CHEMBL3770627) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc([nH]1)-c1ccccc1 Show InChI InChI=1S/C17H15N3.C2H4O2/c18-17(19)14-8-6-13(7-9-14)16-11-10-15(20-16)12-4-2-1-3-5-12;1-2(3)4/h1-11,20H,(H3,18,19);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	332	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515983 (CHEMBL4454218) Show SMILES COc1ccc2nc(cc(N\N=C\c3cccnc3)c2c1)-c1ccccc1 Show InChI InChI=1S/C22H18N4O/c1-27-18-9-10-20-19(12-18)22(26-24-15-16-6-5-11-23-14-16)13-21(25-20)17-7-3-2-4-8-17/h2-15H,1H3,(H,25,26)/b24-15+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	372	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50150657 (CHEMBL3769865) Show SMILES CC(O)=O.Cn1c(ccc1-c1ccc(cc1)C(N)=N)-c1ccccc1 Show InChI InChI=1S/C18H17N3.C2H4O2/c1-21-16(13-5-3-2-4-6-13)11-12-17(21)14-7-9-15(10-8-14)18(19)20;1-2(3)4/h2-12H,1H3,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair
NAD(P)H dehydrogenase [quinone] 1 (Homo sapiens (Human))	BDBM50515975 (CHEMBL4443793) Show SMILES COc1ccc2nc(cc(N\N=C\c3c[nH]cn3)c2c1)-c1ccccc1 Show InChI InChI=1S/C20H17N5O/c1-26-16-7-8-18-17(9-16)20(25-23-12-15-11-21-13-22-15)10-19(24-18)14-5-3-2-4-6-14/h2-13H,1H3,(H,21,22)(H,24,25)/b23-12+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	425	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO1 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM72700 (9-acridinamine;hydrate;hydrochloride | 9-aminoacri...) Show SMILES Nc1c2ccccc2nc2ccccc12 Show InChI InChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515978 (CHEMBL1967497) Show SMILES COc1ccc2nc(C)cc(N\N=C\c3cccc(OC)c3O)c2c1 Show InChI InChI=1S/C19H19N3O3/c1-12-9-17(15-10-14(24-2)7-8-16(15)21-12)22-20-11-13-5-4-6-18(25-3)19(13)23/h4-11,23H,1-3H3,(H,21,22)/b20-11+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of NQO2 in human SKOV3 cells assessed as reduction in cell viability in presence of 1 uM CB1954 and EPR incubated for 24 hrs measured afte...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM72700 (9-acridinamine;hydrate;hydrochloride | 9-aminoacri...) Show SMILES Nc1c2ccccc2nc2ccccc12 Show InChI InChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of NQO2 in human SKOV3 cells assessed as reduction in cell viability in presence of 1 uM CB1954 and EPR incubated for 24 hrs measured afte...				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515993 (CHEMBL4527344) Show SMILES COc1ccc2nc(C)cc(NNC(=O)c3ccccc3)c2c1 Show InChI InChI=1S/C18H17N3O2/c1-12-10-17(15-11-14(23-2)8-9-16(15)19-12)20-21-18(22)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,19,20)(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	472	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli using DCPIP as substrate by spectrophotometry				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50515991 (CHEMBL1891124) Show SMILES C(=C/c1ccc2ccccc2n1)\c1c[nH]c2ccccc12 Show InChI InChI=1S/C19H14N2/c1-3-7-18-14(5-1)9-11-16(21-18)12-10-15-13-20-19-8-4-2-6-17(15)19/h1-13,20H/b12-10+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of recombinant human NQO2 expressed in Escherichia coli BL21 (DE3) using DCPIP as substrate				Eur J Med Chem 182: (2019) Article DOI: 10.1016/j.ejmech.2019.111649 BindingDB Entry DOI: 10.7270/Q2FT8QCK
					More data for this Ligand-Target Pair
Ribosyldihydronicotinamide dehydrogenase [quinone] (Homo sapiens (Human))	BDBM50151017 (CHEMBL3771022) Show SMILES CC(O)=O.NC(=N)c1ccc(cc1)-c1ccc(o1)-c1ccc(F)cc1 Show InChI InChI=1S/C17H13FN2O.C2H4O2/c18-14-7-5-12(6-8-14)16-10-9-15(21-16)11-1-3-13(4-2-11)17(19)20;1-2(3)4/h1-10H,(H3,19,20);1H3,(H,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	505	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibition of human recombinant NQO2 using DCPIPas substrate and NRH as cofactor measured for 1 min by spectrophotometry in the absence of BSA				Eur J Med Chem 111: 33-45 (2016) Article DOI: 10.1016/j.ejmech.2016.01.022 BindingDB Entry DOI: 10.7270/Q2MG7RCQ
					More data for this Ligand-Target Pair

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