null

SMILES: C[C@H](Cc1ccc(OCCCCCCCCCCNc2c3CCCCc3nc3ccccc23)cc1)N(C)CC#C

InChI Key: InChIKey=WQOUNYVRWYXXHY-GDLZYMKVSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50430730   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
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
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))	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))	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