Compile Data Set for Download or QSAR

Found 105 hits with Last Name = 'mall' and Initial = 'g'   

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
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50402408 (CHEMBL2203332) Show SMILES CCCC[N+]1=C(\C=C\c2ccc(cc2)N(CC)CC)C(C)(C)c2ccccc12 |c:4| Show InChI InChI=1S/C26H35N2/c1-6-9-20-28-24-13-11-10-12-23(24)26(4,5)25(28)19-16-21-14-17-22(18-15-21)27(7-2)8-3/h10-19H,6-9,20H2,1-5H3/q+1	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.41	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazine red R from human Tau aggregate expressed in Escherichia coli after 30 mins by fluorimetric analysis				Bioorg Med Chem Lett 22: 7667-71 (2012) Article DOI: 10.1016/j.bmcl.2012.09.109 BindingDB Entry DOI: 10.7270/Q2TQ62PC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398203 (CHEMBL2181533) Show SMILES CN(C)c1ccc(\C=C\C=C\c2cc(\C=C\C=C\c3ccc(cc3)N(C)C)ncn2)cc1 Show InChI InChI=1S/C28H30N4/c1-31(2)27-17-13-23(14-18-27)9-5-7-11-25-21-26(30-22-29-25)12-8-6-10-24-15-19-28(20-16-24)32(3)4/h5-22H,1-4H3/b9-5+,10-6+,11-7+,12-8+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398204 (CHEMBL2181532) Show SMILES C1CCN(C1)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N3CCCC3)ncn2)cc1 Show InChI InChI=1S/C28H30N4/c1-2-18-31(17-1)27-13-7-23(8-14-27)5-11-25-21-26(30-22-29-25)12-6-24-9-15-28(16-10-24)32-19-3-4-20-32/h5-16,21-22H,1-4,17-20H2/b11-5+,12-6+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398207 (CHEMBL2181045) Show SMILES CN(C)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N(C)C)ncn2)cc1 Show InChI InChI=1S/C24H26N4/c1-27(2)23-13-7-19(8-14-23)5-11-21-17-22(26-18-25-21)12-6-20-9-15-24(16-10-20)28(3)4/h5-18H,1-4H3/b11-5+,12-6+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50402407 (CHEMBL2207756) Show SMILES C[N+]1=C(\C=C\c2ccc(cc2)N2CCCC2)C(C)(C)c2ccccc12 |c:1| Show InChI InChI=1S/C23H27N2/c1-23(2)20-8-4-5-9-21(20)24(3)22(23)15-12-18-10-13-19(14-11-18)25-16-6-7-17-25/h4-5,8-15H,6-7,16-17H2,1-3H3/q+1	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazine red R from human Tau aggregate expressed in Escherichia coli after 30 mins by fluorimetric analysis				Bioorg Med Chem Lett 22: 7667-71 (2012) Article DOI: 10.1016/j.bmcl.2012.09.109 BindingDB Entry DOI: 10.7270/Q2TQ62PC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398209 (CHEMBL2181041) Show SMILES C1CN(CCO1)c1ccc(\C=C\c2cnc(\C=C\c3ccc(cc3)N3CCOCC3)cn2)cc1 Show InChI InChI=1S/C28H30N4O2/c1(23-3-9-27(10-4-23)31-13-17-33-18-14-31)7-25-21-30-26(22-29-25)8-2-24-5-11-28(12-6-24)32-15-19-34-20-16-32/h1-12,21-22H,13-20H2/b7-1+,8-2+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM10972 ((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...) Show SMILES [H][C@]12N(C)CC[C@@]1(C)c1cc(OC(=O)NCCCCCCC)ccc1N2C Show InChI InChI=1S/C21H33N3O2/c1-5-6-7-8-9-13-22-20(25)26-16-10-11-18-17(15-16)21(2)12-14-23(3)19(21)24(18)4/h10-11,15,19H,5-9,12-14H2,1-4H3,(H,22,25)/t19-,21+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398210 (CHEMBL2181039) Show SMILES COc1ccc(\C=C\c2cnc(\C=C\c3ccc(OC)cc3)cn2)cc1 Show InChI InChI=1S/C22H20N2O2/c1-25-21-11-5-17(6-12-21)3-9-19-15-24-20(16-23-19)10-4-18-7-13-22(26-2)14-8-18/h3-16H,1-2H3/b9-3+,10-4+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Aldo-keto reductase family 1 member B1 (Homo sapiens (Human))	BDBM7460 (2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...) Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	14.8	n/a	n/a	n/a	n/a	n/a	n/a
Central Food Technological Research Institute Curated by ChEMBL					Assay Description Inhibition of cataracted human eye lens aldose reductase				Bioorg Med Chem 16: 10085-90 (2008) Article DOI: 10.1016/j.bmc.2008.10.003 BindingDB Entry DOI: 10.7270/Q2D21XFD
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398205 (CHEMBL2181531) Show SMILES C1CCN(CC1)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N3CCCCC3)ncn2)cc1 Show InChI InChI=1S/C30H34N4/c1-3-19-33(20-4-1)29-15-9-25(10-16-29)7-13-27-23-28(32-24-31-27)14-8-26-11-17-30(18-12-26)34-21-5-2-6-22-34/h7-18,23-24H,1-6,19-22H2/b13-7+,14-8+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398208 (CHEMBL2181042) Show SMILES CN1CCN(CC1)c1ccc(\C=C\c2cnc(\C=C\c3ccc(cc3)N3CCN(C)CC3)cn2)cc1 Show InChI InChI=1S/C30H36N6/c1-33-15-19-35(20-16-33)29-11-5-25(6-12-29)3-9-27-23-32-28(24-31-27)10-4-26-7-13-30(14-8-26)36-21-17-34(2)18-22-36/h3-14,23-24H,15-22H2,1-2H3/b9-3+,10-4+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50231956 ((Z)-8-bromo-4-methyl-3-(methylimino)-1,2,3,4-tetra...) Show SMILES CN=C1CCc2c1n(C)c1ccc(OC(=O)N(C)C)c(Br)c21 |w:1.0| Show InChI InChI=1S/C16H18BrN3O2/c1-18-10-6-5-9-13-11(20(4)15(9)10)7-8-12(14(13)17)22-16(21)19(2)3/h7-8H,5-6H2,1-4H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288976 (CHEMBL155350 | Methyl-carbamic acid 8-chloro-3-[(Z...) Show SMILES CCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)c(Cl)c21 |w:2.1| Show InChI InChI=1S/C16H18ClN3O2/c1-4-19-10-6-5-9-13-11(20(3)15(9)10)7-8-12(14(13)17)22-16(21)18-2/h7-8H,4-6H2,1-3H3,(H,18,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288977 (CHEMBL160836 | Methyl-carbamic acid 8-bromo-3-[(Z)...) Show SMILES CCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)c(Br)c21 |w:2.1| Show InChI InChI=1S/C16H18BrN3O2/c1-4-19-10-6-5-9-13-11(20(3)15(9)10)7-8-12(14(13)17)22-16(21)18-2/h7-8H,4-6H2,1-3H3,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288981 (CHEMBL160219 | Methyl-carbamic acid 4-methyl-3-[(Z...) Show SMILES CNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1)=NCCc1ccccc1 |w:18.21| Show InChI InChI=1S/C22H23N3O2/c1-23-22(26)27-16-8-11-20-18(14-16)17-9-10-19(21(17)25(20)2)24-13-12-15-6-4-3-5-7-15/h3-8,11,14H,9-10,12-13H2,1-2H3,(H,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288976 (CHEMBL155350 | Methyl-carbamic acid 8-chloro-3-[(Z...) Show SMILES CCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)c(Cl)c21 |w:2.1| Show InChI InChI=1S/C16H18ClN3O2/c1-4-19-10-6-5-9-13-11(20(3)15(9)10)7-8-12(14(13)17)22-16(21)18-2/h7-8H,4-6H2,1-3H3,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288966 (CHEMBL156861 | Methyl-carbamic acid 8-bromo-4-meth...) Show SMILES CNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1Br)=NC |w:19.22| Show InChI InChI=1S/C15H16BrN3O2/c1-17-9-5-4-8-12-10(19(3)14(8)9)6-7-11(13(12)16)21-15(20)18-2/h6-7H,4-5H2,1-3H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288969 (4-(7-Bromo-5-methoxy-benzofuran-2-yl)-piperidine |...) Show SMILES COc1cc(Br)c2oc(cc2c1)C1CCNCC1 Show InChI InChI=1S/C14H16BrNO2/c1-17-11-6-10-7-13(9-2-4-16-5-3-9)18-14(10)12(15)8-11/h6-9,16H,2-5H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents	Article	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288977 (CHEMBL160836 | Methyl-carbamic acid 8-bromo-3-[(Z)...) Show SMILES CCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)c(Br)c21 |w:2.1| Show InChI InChI=1S/C16H18BrN3O2/c1-4-19-10-6-5-9-13-11(20(3)15(9)10)7-8-12(14(13)17)22-16(21)18-2/h7-8H,4-6H2,1-3H3,(H,18,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288975 (CHEMBL445916 | Methyl-carbamic acid 8-bromo-3-[(Z)...) Show SMILES CCCn1c2C(CCc2c2c(Br)c(OC(=O)NC)ccc12)=NCC |w:21.24| Show InChI InChI=1S/C18H22BrN3O2/c1-4-10-22-13-8-9-14(24-18(23)20-3)16(19)15(13)11-6-7-12(17(11)22)21-5-2/h8-9H,4-7,10H2,1-3H3,(H,20,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288979 (CHEMBL155754 | Methyl-carbamic acid 8-chloro-4-met...) Show SMILES CNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1Cl)=NC |w:19.22| Show InChI InChI=1S/C15H16ClN3O2/c1-17-9-5-4-8-12-10(19(3)14(8)9)6-7-11(13(12)16)21-15(20)18-2/h6-7H,4-5H2,1-3H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398211 (CHEMBL2181036) Show SMILES COc1cc(\C=C\c2ccc(O)cc2)ccc1\C=C\c1ccc(O)cc1 Show InChI InChI=1S/C23H20O3/c1-26-23-16-19(3-2-17-6-12-21(24)13-7-17)5-11-20(23)10-4-18-8-14-22(25)15-9-18/h2-16,24-25H,1H3/b3-2+,10-4+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	246	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398211 (CHEMBL2181036) Show SMILES COc1cc(\C=C\c2ccc(O)cc2)ccc1\C=C\c1ccc(O)cc1 Show InChI InChI=1S/C23H20O3/c1-26-23-16-19(3-2-17-6-12-21(24)13-7-17)5-11-20(23)10-4-18-8-14-22(25)15-9-18/h2-16,24-25H,1H3/b3-2+,10-4+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	246	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazine red R from human Tau aggregate expressed in Escherichia coli after 30 mins by fluorimetric analysis				Bioorg Med Chem Lett 22: 7667-71 (2012) Article DOI: 10.1016/j.bmcl.2012.09.109 BindingDB Entry DOI: 10.7270/Q2TQ62PC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50231956 ((Z)-8-bromo-4-methyl-3-(methylimino)-1,2,3,4-tetra...) Show SMILES CN=C1CCc2c1n(C)c1ccc(OC(=O)N(C)C)c(Br)c21 |w:1.0| Show InChI InChI=1S/C16H18BrN3O2/c1-18-10-6-5-9-13-11(20(4)15(9)10)7-8-12(14(13)17)22-16(21)19(2)3/h7-8H,5-6H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288966 (CHEMBL156861 | Methyl-carbamic acid 8-bromo-4-meth...) Show SMILES CNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1Br)=NC |w:19.22| Show InChI InChI=1S/C15H16BrN3O2/c1-17-9-5-4-8-12-10(19(3)14(8)9)6-7-11(13(12)16)21-15(20)18-2/h6-7H,4-5H2,1-3H3,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288973 (CHEMBL157182 | Methyl-carbamic acid 6-chloro-4-met...) Show SMILES CNC(=O)Oc1cc2c3CCC(=NC)c3n(C)c2cc1Cl |w:12.12| Show InChI InChI=1S/C15H16ClN3O2/c1-17-11-5-4-8-9-6-13(21-15(20)18-2)10(16)7-12(9)19(3)14(8)11/h6-7H,4-5H2,1-3H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	670	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288967 (Butyl-carbamic acid 8-bromo-4-methyl-3-[(Z)-methyl...) Show SMILES CCCCNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1Br)=NC |w:22.25| Show InChI InChI=1S/C18H22BrN3O2/c1-4-5-10-21-18(23)24-14-9-8-13-15(16(14)19)11-6-7-12(20-2)17(11)22(13)3/h8-9H,4-7,10H2,1-3H3,(H,21,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288970 (CHEMBL346766 | Methyl-[4-methyl-1,4-dihydro-2H-cyc...) Show SMILES CN=C1CCc2c1n(C)c1ccccc21 |w:1.0| Show InChI InChI=1S/C13H14N2/c1-14-11-8-7-10-9-5-3-4-6-12(9)15(2)13(10)11/h3-6H,7-8H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	920	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398200 (CHEMBL2181538) Show SMILES CN(C)c1ccc(\C=C\c2cc(c(\C=C\c3ccc(cc3)N(C)C)nn2)-c2ccccc2F)cc1 Show InChI InChI=1S/C30H29FN4/c1-34(2)25-16-10-22(11-17-25)9-15-24-21-28(27-7-5-6-8-29(27)31)30(33-32-24)20-14-23-12-18-26(19-13-23)35(3)4/h5-21H,1-4H3/b15-9+,20-14+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288979 (CHEMBL155754 | Methyl-carbamic acid 8-chloro-4-met...) Show SMILES CNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1Cl)=NC |w:19.22| Show InChI InChI=1S/C15H16ClN3O2/c1-17-9-5-4-8-12-10(19(3)14(8)9)6-7-11(13(12)16)21-15(20)18-2/h6-7H,4-5H2,1-3H3,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398201 (CHEMBL2181537) Show SMILES COc1ccc(cc1)-c1cc(\C=C\c2ccc(cc2)N(C)C)nnc1\C=C\c1ccc(cc1)N(C)C Show InChI InChI=1S/C31H32N4O/c1-34(2)27-15-7-23(8-16-27)6-14-26-22-30(25-12-19-29(36-5)20-13-25)31(33-32-26)21-11-24-9-17-28(18-10-24)35(3)4/h6-22H,1-5H3/b14-6+,21-11+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288971 (CHEMBL156919 | [4-Methyl-1,4-dihydro-2H-cyclopenta...) Show SMILES CCCN=C1CCc2c1n(C)c1ccccc21 |w:3.2| Show InChI InChI=1S/C15H18N2/c1-3-10-16-13-9-8-12-11-6-4-5-7-14(11)17(2)15(12)13/h4-7H,3,8-10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50185987 (2-(1-(6-((2-fluoroethyl)(methyl)amino)naphthalen-2...) Show SMILES [#6]-[#7](-[#6]-[#6]F)-c1ccc2cc(ccc2c1)-[#6](\[#6])=[#6](\C#N)C#N Show InChI InChI=1S/C18H16FN3/c1-13(17(11-20)12-21)14-3-4-16-10-18(22(2)8-7-19)6-5-15(16)9-14/h3-6,9-10H,7-8H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazine red R from human Tau aggregate expressed in Escherichia coli after 30 mins by fluorimetric analysis				Bioorg Med Chem Lett 22: 7667-71 (2012) Article DOI: 10.1016/j.bmcl.2012.09.109 BindingDB Entry DOI: 10.7270/Q2TQ62PC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288965 (CHEMBL347197 | Ethyl-[4-methyl-1,4-dihydro-2H-cycl...) Show SMILES CCN=C1CCc2c1n(C)c1ccccc21 |w:2.1| Show InChI InChI=1S/C14H16N2/c1-3-15-12-9-8-11-10-6-4-5-7-13(10)16(2)14(11)12/h4-7H,3,8-9H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288967 (Butyl-carbamic acid 8-bromo-4-methyl-3-[(Z)-methyl...) Show SMILES CCCCNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1Br)=NC |w:22.25| Show InChI InChI=1S/C18H22BrN3O2/c1-4-5-10-21-18(23)24-14-9-8-13-15(16(14)19)11-6-7-12(20-2)17(11)22(13)3/h8-9H,4-7,10H2,1-3H3,(H,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50129793 (2-(4''-methylaminophenyl)-6-hydroxybenzothiazole |...) Show SMILES CNc1ccc(cc1)-c1nc2ccc(O)cc2s1 Show InChI InChI=1S/C14H12N2OS/c1-15-10-4-2-9(3-5-10)14-16-12-7-6-11(17)8-13(12)18-14/h2-8,15,17H,1H3	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazine red R from human Tau aggregate expressed in Escherichia coli after 30 mins by fluorimetric analysis				Bioorg Med Chem Lett 22: 7667-71 (2012) Article DOI: 10.1016/j.bmcl.2012.09.109 BindingDB Entry DOI: 10.7270/Q2TQ62PC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288968 (CHEMBL156931 | Methyl-carbamic acid 4-methyl-3-[(Z...) Show SMILES CNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1)=NC |w:18.21| Show InChI InChI=1S/C15H17N3O2/c1-16-12-6-5-10-11-8-9(20-15(19)17-2)4-7-13(11)18(3)14(10)12/h4,7-8H,5-6H2,1-3H3,(H,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288972 (CHEMBL350464 | Methyl-carbamic acid 3-[(Z)-ethylim...) Show SMILES CCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)cc21 |w:2.1| Show InChI InChI=1S/C16H19N3O2/c1-4-18-13-7-6-11-12-9-10(21-16(20)17-2)5-8-14(12)19(3)15(11)13/h5,8-9H,4,6-7H2,1-3H3,(H,17,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288974 (CHEMBL155863 | Methyl-carbamic acid 4-methyl-3-[(Z...) Show SMILES CCCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)cc21 |w:3.2| Show InChI InChI=1S/C17H21N3O2/c1-4-9-19-14-7-6-12-13-10-11(22-17(21)18-2)5-8-15(13)20(3)16(12)14/h5,8,10H,4,6-7,9H2,1-3H3,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.84E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288982 (Benzyl-carbamic acid 8-bromo-4-methyl-3-[(Z)-methy...) Show SMILES CN=C1CCc2c1n(C)c1ccc(OC(=O)NCc3ccccc3)c(Br)c21 |w:1.0| Show InChI InChI=1S/C21H20BrN3O2/c1-23-15-9-8-14-18-16(25(2)20(14)15)10-11-17(19(18)22)27-21(26)24-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3,(H,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	4.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398202 (CHEMBL2181535) Show SMILES C1CN(CCO1)c1ccc(\C=C\c2cc(c(\C=C\c3ccc(cc3)N3CCOCC3)nn2)-c2ccccc2)cc1 Show InChI InChI=1S/C34H34N4O2/c1-2-4-29(5-3-1)33-26-30(12-6-27-7-13-31(14-8-27)37-18-22-39-23-19-37)35-36-34(33)17-11-28-9-15-32(16-10-28)38-20-24-40-25-21-38/h1-17,26H,18-25H2/b12-6+,17-11+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.71E+3	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288982 (Benzyl-carbamic acid 8-bromo-4-methyl-3-[(Z)-methy...) Show SMILES CN=C1CCc2c1n(C)c1ccc(OC(=O)NCc3ccccc3)c(Br)c21 |w:1.0| Show InChI InChI=1S/C21H20BrN3O2/c1-23-15-9-8-14-18-16(25(2)20(14)15)10-11-17(19(18)22)27-21(26)24-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3,(H,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	5.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50288972 (CHEMBL350464 | Methyl-carbamic acid 3-[(Z)-ethylim...) Show SMILES CCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)cc21 |w:2.1| Show InChI InChI=1S/C16H19N3O2/c1-4-18-13-7-6-11-12-9-10(21-16(20)17-2)5-8-14(12)19(3)15(11)13/h5,8-9H,4,6-7H2,1-3H3,(H,17,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	5.68E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of acetylcholinesterase.				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50398206 (CHEMBL2181047) Show SMILES CN1CCN(CC1)c1ccc(\C=C\c2cc(\C=C\c3ccc(cc3)N3CCN(C)CC3)ncn2)cc1 Show InChI InChI=1S/C30H36N6/c1-33-15-19-35(20-16-33)29-11-5-25(6-12-29)3-9-27-23-28(32-24-31-27)10-4-26-7-13-30(14-8-26)36-21-17-34(2)18-22-36/h3-14,23-24H,15-22H2,1-2H3/b9-3+,10-4+	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazene red from tau aggregate				J Med Chem 55: 9170-80 (2012) Article DOI: 10.1021/jm300653b BindingDB Entry DOI: 10.7270/Q2PC33HQ
					More data for this Ligand-Target Pair
Microtubule-associated protein tau (Homo sapiens (Human))	BDBM50402406 (CHEMBL2069534) Show SMILES CNc1ccc(cc1)-c1ccc2ccccc2n1 Show InChI InChI=1S/C16H14N2/c1-17-14-9-6-13(7-10-14)16-11-8-12-4-2-3-5-15(12)18-16/h2-11,17H,1H3	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universit£t Darmstadt Curated by ChEMBL					Assay Description Displacement of thiazine red R from human Tau aggregate expressed in Escherichia coli after 30 mins by fluorimetric analysis				Bioorg Med Chem Lett 22: 7667-71 (2012) Article DOI: 10.1016/j.bmcl.2012.09.109 BindingDB Entry DOI: 10.7270/Q2TQ62PC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288968 (CHEMBL156931 | Methyl-carbamic acid 4-methyl-3-[(Z...) Show SMILES CNC(=O)Oc1ccc2n(C)c3C(CCc3c2c1)=NC |w:18.21| Show InChI InChI=1S/C15H17N3O2/c1-16-12-6-5-10-11-8-9(20-15(19)17-2)4-7-13(11)18(3)14(10)12/h4,7-8H,5-6H2,1-3H3,(H,17,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	1.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288973 (CHEMBL157182 | Methyl-carbamic acid 6-chloro-4-met...) Show SMILES CNC(=O)Oc1cc2c3CCC(=NC)c3n(C)c2cc1Cl |w:12.12| Show InChI InChI=1S/C15H16ClN3O2/c1-17-11-5-4-8-9-6-13(21-15(20)18-2)10(16)7-12(9)19(3)14(8)11/h6-7H,4-5H2,1-3H3,(H,18,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50288969 (4-(7-Bromo-5-methoxy-benzofuran-2-yl)-piperidine |...) Show SMILES COc1cc(Br)c2oc(cc2c1)C1CCNCC1 Show InChI InChI=1S/C14H16BrNO2/c1-17-11-6-10-7-13(9-2-4-16-5-3-9)18-14(10)12(15)8-11/h6-9,16H,2-5H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents	Article	n/a	n/a	2.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-B(MAO-B).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288974 (CHEMBL155863 | Methyl-carbamic acid 4-methyl-3-[(Z...) Show SMILES CCCN=C1CCc2c1n(C)c1ccc(OC(=O)NC)cc21 |w:3.2| Show InChI InChI=1S/C17H21N3O2/c1-4-9-19-14-7-6-12-13-10-11(22-17(21)18-2)5-8-15(13)20(3)16(12)14/h5,8,10H,4,6-7,9H2,1-3H3,(H,18,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2.54E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50288978 (CHEMBL348083 | Isopropyl-[4-methyl-1,4-dihydro-2H-...) Show SMILES CC(C)N=C1CCc2c1n(C)c1ccccc21 |w:3.2| Show InChI InChI=1S/C15H18N2/c1-10(2)16-13-9-8-12-11-6-4-5-7-14(11)17(3)15(12)13/h4-7,10H,8-9H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	3.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of monoamine oxidase-A(MAO-A).				Bioorg Med Chem Lett 6: 625-630 (1996) Article DOI: 10.1016/0960-894X(96)00072-8 BindingDB Entry DOI: 10.7270/Q22J6BVC
					More data for this Ligand-Target Pair

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