Compile Data Set for Download or QSAR

Found 56 hits Enz. Inhib. hit(s) with all data for entry = 50042768   

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
Cholinesterase (Equus caballus (Horse))	BDBM50430730 (CHEMBL2333926) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C36H49N3O/c1-4-26-39(3)29(2)28-30-21-23-31(24-22-30)40-27-16-10-8-6-5-7-9-15-25-37-36-32-17-11-13-19-34(32)38-35-20-14-12-18-33(35)36/h1,11,13,17,19,21-24,29H,5-10,12,14-16,18,20,25-28H2,2-3H3,(H,37,38)/t29-/m1/s1	PDB UniProtKB/SwissProt 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
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM15581 (CHEMBL8706 | CLG | CLORGILINE | Clorgyline | N-[3-...) Show SMILES CN(CCCOc1ccc(Cl)cc1Cl)CC#C Show InChI InChI=1S/C13H15Cl2NO/c1-3-7-16(2)8-4-9-17-13-6-5-11(14)10-12(13)15/h1,5-6,10H,4,7-9H2,2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Cholinesterase (Equus caballus (Horse))	BDBM50430731 (CHEMBL2333925) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C35H47N3O/c1-4-25-38(3)28(2)27-29-20-22-30(23-21-29)39-26-15-9-7-5-6-8-14-24-36-35-31-16-10-12-18-33(31)37-34-19-13-11-17-32(34)35/h1,10,12,16,18,20-23,28H,5-9,11,13-15,17,19,24-27H2,2-3H3,(H,36,37)/t28-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.40	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430729 (CHEMBL2333927) Show SMILES C[C@H](Cc1ccc(OCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C29H34ClN3O/c1-4-17-33(3)21(2)19-22-10-13-24(14-11-22)34-18-7-16-31-29-25-8-5-6-9-27(25)32-28-20-23(30)12-15-26(28)29/h1,10-15,20-21H,5-9,16-19H2,2-3H3,(H,31,32)/t21-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430733 (CHEMBL2333936) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H41N3O/c1-4-22-35(3)25(2)24-26-17-19-27(20-18-26)36-23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430726 (CHEMBL2333930) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H44ClN3O/c1-4-22-38(3)26(2)24-27-15-18-29(19-16-27)39-23-12-8-6-5-7-11-21-36-34-30-13-9-10-14-32(30)37-33-25-28(35)17-20-31(33)34/h1,15-20,25-26H,5-14,21-24H2,2-3H3,(H,36,37)/t26-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430727 (CHEMBL2333929) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H40ClN3O/c1-4-20-36(3)24(2)22-25-13-16-27(17-14-25)37-21-10-6-5-9-19-34-32-28-11-7-8-12-30(28)35-31-23-26(33)15-18-29(31)32/h1,13-18,23-24H,5-12,19-22H2,2-3H3,(H,34,35)/t24-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430728 (CHEMBL2333928) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H38ClN3O/c1-4-19-35(3)23(2)21-24-12-15-26(16-13-24)36-20-9-5-8-18-33-31-27-10-6-7-11-29(27)34-30-22-25(32)14-17-28(30)31/h1,12-17,22-23H,5-11,18-21H2,2-3H3,(H,33,34)/t23-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM8961 (1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...) Show SMILES Nc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430731 (CHEMBL2333925) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C35H47N3O/c1-4-25-38(3)28(2)27-29-20-22-30(23-21-29)39-26-15-9-7-5-6-8-14-24-36-35-31-16-10-12-18-33(31)37-34-19-13-11-17-32(34)35/h1,10,12,16,18,20-23,28H,5-9,11,13-15,17,19,24-27H2,2-3H3,(H,36,37)/t28-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430730 (CHEMBL2333926) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C36H49N3O/c1-4-26-39(3)29(2)28-30-21-23-31(24-22-30)40-27-16-10-8-6-5-7-9-15-25-37-36-32-17-11-13-19-34(32)38-35-20-14-12-18-33(35)36/h1,11,13,17,19,21-24,29H,5-10,12,14-16,18,20,25-28H2,2-3H3,(H,37,38)/t29-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430734 (CHEMBL2333935) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H39N3O/c1-4-21-34(3)24(2)23-25-16-18-26(19-17-25)35-22-11-5-10-20-32-31-27-12-6-8-14-29(27)33-30-15-9-7-13-28(30)31/h1,6,8,12,14,16-19,24H,5,7,9-11,13,15,20-23H2,2-3H3,(H,32,33)/t24-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430725 (CHEMBL2333931) Show SMILES COc1ccc(C[C@@H](C)N(CCCCCCNc2c3CCCCc3nc3ccccc23)CC#C)cc1 |r| Show InChI InChI=1S/C32H41N3O/c1-4-22-35(25(2)24-26-17-19-27(36-3)20-18-26)23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430732 (CHEMBL2333937) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H45N3O/c1-4-24-37(3)27(2)26-28-19-21-29(22-20-28)38-25-14-8-6-5-7-13-23-35-34-30-15-9-11-17-32(30)36-33-18-12-10-16-31(33)34/h1,9,11,15,17,19-22,27H,5-8,10,12-14,16,18,23-26H2,2-3H3,(H,35,36)/t27-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430736 (CHEMBL2333933) Show SMILES C[C@H](Cc1ccc(OCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C29H35N3O/c1-4-19-32(3)22(2)21-23-14-16-24(17-15-23)33-20-9-18-30-29-25-10-5-7-12-27(25)31-28-13-8-6-11-26(28)29/h1,5,7,10,12,14-17,22H,6,8-9,11,13,18-21H2,2-3H3,(H,30,31)/t22-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430735 (CHEMBL2333934) Show SMILES C[C@H](Cc1ccc(OCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C30H37N3O/c1-4-20-33(3)23(2)22-24-15-17-25(18-16-24)34-21-10-9-19-31-30-26-11-5-7-13-28(26)32-29-14-8-6-12-27(29)30/h1,5,7,11,13,15-18,23H,6,8-10,12,14,19-22H2,2-3H3,(H,31,32)/t23-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430736 (CHEMBL2333933) Show SMILES C[C@H](Cc1ccc(OCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C29H35N3O/c1-4-19-32(3)22(2)21-23-14-16-24(17-15-23)33-20-9-18-30-29-25-10-5-7-12-27(25)31-28-13-8-6-11-26(28)29/h1,5,7,10,12,14-17,22H,6,8-9,11,13,18-21H2,2-3H3,(H,30,31)/t22-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430737 (CHEMBL2333932) Show SMILES C[C@H](Cc1ccc(OCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C28H33N3O/c1-4-18-31(3)21(2)20-22-13-15-23(16-14-22)32-19-17-29-28-24-9-5-7-11-26(24)30-27-12-8-6-10-25(27)28/h1,5,7,9,11,13-16,21H,6,8,10,12,17-20H2,2-3H3,(H,29,30)/t21-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430735 (CHEMBL2333934) Show SMILES C[C@H](Cc1ccc(OCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C30H37N3O/c1-4-20-33(3)23(2)22-24-15-17-25(18-16-24)34-21-10-9-19-31-30-26-11-5-7-13-28(26)32-29-14-8-6-12-27(29)30/h1,5,7,11,13,15-18,23H,6,8-10,12,14,19-22H2,2-3H3,(H,31,32)/t23-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430726 (CHEMBL2333930) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H44ClN3O/c1-4-22-38(3)26(2)24-27-15-18-29(19-16-27)39-23-12-8-6-5-7-11-21-36-34-30-13-9-10-14-32(30)37-33-25-28(35)17-20-31(33)34/h1,15-20,25-26H,5-14,21-24H2,2-3H3,(H,36,37)/t26-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50430729 (CHEMBL2333927) Show SMILES C[C@H](Cc1ccc(OCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C29H34ClN3O/c1-4-17-33(3)21(2)19-22-10-13-24(14-11-22)34-18-7-16-31-29-25-8-5-6-9-27(25)32-28-20-23(30)12-15-26(28)29/h1,10-15,20-21H,5-9,16-19H2,2-3H3,(H,31,32)/t21-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE using butylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430734 (CHEMBL2333935) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H39N3O/c1-4-21-34(3)24(2)23-25-16-18-26(19-17-25)35-22-11-5-10-20-32-31-27-12-6-8-14-29(27)33-30-15-9-7-13-28(30)31/h1,6,8,12,14,16-19,24H,5,7,9-11,13,15,20-23H2,2-3H3,(H,32,33)/t24-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430727 (CHEMBL2333929) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H40ClN3O/c1-4-20-36(3)24(2)22-25-13-16-27(17-14-25)37-21-10-6-5-9-19-34-32-28-11-7-8-12-30(28)35-31-23-26(33)15-18-29(31)32/h1,13-18,23-24H,5-12,19-22H2,2-3H3,(H,34,35)/t24-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430728 (CHEMBL2333928) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H38ClN3O/c1-4-19-35(3)23(2)21-24-12-15-26(16-13-24)36-20-9-5-8-18-33-31-27-10-6-7-11-29(27)34-30-22-25(32)14-17-28(30)31/h1,12-17,22-23H,5-11,18-21H2,2-3H3,(H,33,34)/t23-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	82	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430737 (CHEMBL2333932) Show SMILES C[C@H](Cc1ccc(OCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C28H33N3O/c1-4-18-31(3)21(2)20-22-13-15-23(16-14-22)32-19-17-29-28-24-9-5-7-11-26(24)30-27-12-8-6-10-25(27)28/h1,5,7,9,11,13-16,21H,6,8,10,12,17-20H2,2-3H3,(H,29,30)/t21-/m1/s1	UniProtKB/SwissProt 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
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM8961 (1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...) Show SMILES Nc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430726 (CHEMBL2333930) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H44ClN3O/c1-4-22-38(3)26(2)24-27-15-18-29(19-16-27)39-23-12-8-6-5-7-11-21-36-34-30-13-9-10-14-32(30)37-33-25-28(35)17-20-31(33)34/h1,15-20,25-26H,5-14,21-24H2,2-3H3,(H,36,37)/t26-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	129	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430733 (CHEMBL2333936) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H41N3O/c1-4-22-35(3)25(2)24-26-17-19-27(20-18-26)36-23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	138	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430732 (CHEMBL2333937) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H45N3O/c1-4-24-37(3)27(2)26-28-19-21-29(22-20-28)38-25-14-8-6-5-7-13-23-35-34-30-15-9-11-17-32(30)36-33-18-12-10-16-31(33)34/h1,9,11,15,17,19-22,27H,5-8,10,12-14,16,18,23-26H2,2-3H3,(H,35,36)/t27-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	147	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430732 (CHEMBL2333937) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H45N3O/c1-4-24-37(3)27(2)26-28-19-21-29(22-20-28)38-25-14-8-6-5-7-13-23-35-34-30-15-9-11-17-32(30)36-33-18-12-10-16-31(33)34/h1,9,11,15,17,19-22,27H,5-8,10,12-14,16,18,23-26H2,2-3H3,(H,35,36)/t27-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	167	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430731 (CHEMBL2333925) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C35H47N3O/c1-4-25-38(3)28(2)27-29-20-22-30(23-21-29)39-26-15-9-7-5-6-8-14-24-36-35-31-16-10-12-18-33(31)37-34-19-13-11-17-32(34)35/h1,10,12,16,18,20-23,28H,5-9,11,13-15,17,19,24-27H2,2-3H3,(H,36,37)/t28-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	181	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50172756 (Benzyl-methyl-prop-2-ynyl-amine | CHEMBL673 | Euto...) Show SMILES CN(CC#C)Cc1ccccc1 Show InChI InChI=1S/C11H13N/c1-3-9-12(2)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	188	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430726 (CHEMBL2333930) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H44ClN3O/c1-4-22-38(3)26(2)24-27-15-18-29(19-16-27)39-23-12-8-6-5-7-11-21-36-34-30-13-9-10-14-32(30)37-33-25-28(35)17-20-31(33)34/h1,15-20,25-26H,5-14,21-24H2,2-3H3,(H,36,37)/t26-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	193	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430733 (CHEMBL2333936) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H41N3O/c1-4-22-35(3)25(2)24-26-17-19-27(20-18-26)36-23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	209	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430730 (CHEMBL2333926) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C36H49N3O/c1-4-26-39(3)29(2)28-30-21-23-31(24-22-30)40-27-16-10-8-6-5-7-9-15-25-37-36-32-17-11-13-19-34(32)38-35-20-14-12-18-33(35)36/h1,11,13,17,19,21-24,29H,5-10,12,14-16,18,20,25-28H2,2-3H3,(H,37,38)/t29-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	313	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430730 (CHEMBL2333926) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C36H49N3O/c1-4-26-39(3)29(2)28-30-21-23-31(24-22-30)40-27-16-10-8-6-5-7-9-15-25-37-36-32-17-11-13-19-34(32)38-35-20-14-12-18-33(35)36/h1,11,13,17,19,21-24,29H,5-10,12,14-16,18,20,25-28H2,2-3H3,(H,37,38)/t29-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	346	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430731 (CHEMBL2333925) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C35H47N3O/c1-4-25-38(3)28(2)27-29-20-22-30(23-21-29)39-26-15-9-7-5-6-8-14-24-36-35-31-16-10-12-18-33(31)37-34-19-13-11-17-32(34)35/h1,10,12,16,18,20-23,28H,5-9,11,13-15,17,19,24-27H2,2-3H3,(H,36,37)/t28-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	372	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430733 (CHEMBL2333936) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H41N3O/c1-4-22-35(3)25(2)24-26-17-19-27(20-18-26)36-23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	398	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50430725 (CHEMBL2333931) Show SMILES COc1ccc(C[C@@H](C)N(CCCCCCNc2c3CCCCc3nc3ccccc23)CC#C)cc1 |r| Show InChI InChI=1S/C32H41N3O/c1-4-22-35(25(2)24-26-17-19-27(36-3)20-18-26)23-12-6-5-11-21-33-32-28-13-7-9-15-30(28)34-31-16-10-8-14-29(31)32/h1,7,9,13,15,17-20,25H,5-6,8,10-12,14,16,21-24H2,2-3H3,(H,33,34)/t25-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	456	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine chloride as substrate after 15 mins by Ellman's method				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430727 (CHEMBL2333929) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H40ClN3O/c1-4-20-36(3)24(2)22-25-13-16-27(17-14-25)37-21-10-6-5-9-19-34-32-28-11-7-8-12-30(28)35-31-23-26(33)15-18-29(31)32/h1,13-18,23-24H,5-12,19-22H2,2-3H3,(H,34,35)/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	519	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430727 (CHEMBL2333929) Show SMILES C[C@H](Cc1ccc(OCCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C32H40ClN3O/c1-4-20-36(3)24(2)22-25-13-16-27(17-14-25)37-21-10-6-5-9-19-34-32-28-11-7-8-12-30(28)35-31-23-26(33)15-18-29(31)32/h1,13-18,23-24H,5-12,19-22H2,2-3H3,(H,34,35)/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	521	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430732 (CHEMBL2333937) Show SMILES C[C@H](Cc1ccc(OCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C34H45N3O/c1-4-24-37(3)27(2)26-28-19-21-29(22-20-28)38-25-14-8-6-5-7-13-23-35-34-30-15-9-11-17-32(30)36-33-18-12-10-16-31(33)34/h1,9,11,15,17,19-22,27H,5-8,10,12-14,16,18,23-26H2,2-3H3,(H,35,36)/t27-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	591	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430737 (CHEMBL2333932) Show SMILES C[C@H](Cc1ccc(OCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C28H33N3O/c1-4-18-31(3)21(2)20-22-13-15-23(16-14-22)32-19-17-29-28-24-9-5-7-11-26(24)30-27-12-8-6-10-25(27)28/h1,5,7,9,11,13-16,21H,6,8,10,12,17-20H2,2-3H3,(H,29,30)/t21-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	693	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430734 (CHEMBL2333935) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H39N3O/c1-4-21-34(3)24(2)23-25-16-18-26(19-17-25)35-22-11-5-10-20-32-31-27-12-6-8-14-29(27)33-30-15-9-7-13-28(30)31/h1,6,8,12,14,16-19,24H,5,7,9-11,13,15,20-23H2,2-3H3,(H,32,33)/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430734 (CHEMBL2333935) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H39N3O/c1-4-21-34(3)24(2)23-25-16-18-26(19-17-25)35-22-11-5-10-20-32-31-27-12-6-8-14-29(27)33-30-15-9-7-13-28(30)31/h1,6,8,12,14,16-19,24H,5,7,9-11,13,15,20-23H2,2-3H3,(H,32,33)/t24-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430728 (CHEMBL2333928) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H38ClN3O/c1-4-19-35(3)23(2)21-24-12-15-26(16-13-24)36-20-9-5-8-18-33-31-27-10-6-7-11-29(27)34-30-22-25(32)14-17-28(30)31/h1,12-17,22-23H,5-11,18-21H2,2-3H3,(H,33,34)/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430736 (CHEMBL2333933) Show SMILES C[C@H](Cc1ccc(OCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C29H35N3O/c1-4-19-32(3)22(2)21-23-14-16-24(17-15-23)33-20-9-18-30-29-25-10-5-7-12-27(25)31-28-13-8-6-11-26(28)29/h1,5,7,10,12,14-17,22H,6,8-9,11,13,18-21H2,2-3H3,(H,30,31)/t22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430737 (CHEMBL2333932) Show SMILES C[C@H](Cc1ccc(OCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C28H33N3O/c1-4-18-31(3)21(2)20-22-13-15-23(16-14-22)32-19-17-29-28-24-9-5-7-11-26(24)30-27-12-8-6-10-25(27)28/h1,5,7,9,11,13-16,21H,6,8,10,12,17-20H2,2-3H3,(H,29,30)/t21-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50430728 (CHEMBL2333928) Show SMILES C[C@H](Cc1ccc(OCCCCCNc2c3CCCCc3nc3cc(Cl)ccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C31H38ClN3O/c1-4-19-35(3)23(2)21-24-12-15-26(16-13-24)36-20-9-5-8-18-33-31-27-10-6-7-11-29(27)34-30-22-25(32)14-17-28(30)31/h1,12-17,22-23H,5-11,18-21H2,2-3H3,(H,33,34)/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-B using p-benzylamine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluo...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM50430735 (CHEMBL2333934) Show SMILES C[C@H](Cc1ccc(OCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C |r| Show InChI InChI=1S/C30H37N3O/c1-4-20-33(3)23(2)22-24-15-17-25(18-16-24)34-21-10-9-19-31-30-26-11-5-7-13-28(26)32-29-14-8-6-12-27(29)30/h1,5,7,11,13,15-18,23H,6,8-10,12,14,19-22H2,2-3H3,(H,31,32)/t23-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of recombinant human MAO-A using p-tyramine substrate preincubated for 15 mins before substrate addition measured after 20 mins by fluores...				Eur J Med Chem 62: 745-53 (2013) Article DOI: 10.1016/j.ejmech.2013.01.039 BindingDB Entry DOI: 10.7270/Q2C82BN6
					More data for this Ligand-Target Pair

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