null

SMILES: CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc(Br)cs1

InChI Key: InChIKey=RRISCGLVYBLGLP-SANMLTNESA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50311999   

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
Acetylcholinesterase (Bos taurus (bovine))	BDBM50311999 ((S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)...) Show SMILES CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc(Br)cs1 |r| Show InChI InChI=1S/C30H42BrN3O4S/c1-2-3-4-8-19-38-30(37)26(33-29(36)27-20-25(31)22-39-27)11-12-28(35)32-16-13-23-14-17-34(18-15-23)21-24-9-6-5-7-10-24/h5-7,9-10,20,22-23,26H,2-4,8,11-19,21H2,1H3,(H,32,35)(H,33,36)/t26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Quimica Medica (CSIC) Curated by ChEMBL					Assay Description Inhibition of AChE in bovine erythrocyte by Ellman method				J Med Chem 52: 7249-57 (2009) Article DOI: 10.1021/jm900628z BindingDB Entry DOI: 10.7270/Q2668DB1
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50311999 ((S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)...) Show SMILES CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc(Br)cs1 |r| Show InChI InChI=1S/C30H42BrN3O4S/c1-2-3-4-8-19-38-30(37)26(33-29(36)27-20-25(31)22-39-27)11-12-28(35)32-16-13-23-14-17-34(18-15-23)21-24-9-6-5-7-10-24/h5-7,9-10,20,22-23,26H,2-4,8,11-19,21H2,1H3,(H,32,35)(H,33,36)/t26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	850	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Quimica Medica (CSIC) Curated by ChEMBL					Assay Description Inhibition of human BuChE in serum				J Med Chem 52: 7249-57 (2009) Article DOI: 10.1021/jm900628z BindingDB Entry DOI: 10.7270/Q2668DB1
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50311999 ((S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)...) Show SMILES CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc(Br)cs1 |r| Show InChI InChI=1S/C30H42BrN3O4S/c1-2-3-4-8-19-38-30(37)26(33-29(36)27-20-25(31)22-39-27)11-12-28(35)32-16-13-23-14-17-34(18-15-23)21-24-9-6-5-7-10-24/h5-7,9-10,20,22-23,26H,2-4,8,11-19,21H2,1H3,(H,32,35)(H,33,36)/t26-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Quimica Medica (CSIC) Curated by ChEMBL					Assay Description Inhibition of human AChE in erythrocyte				J Med Chem 52: 7249-57 (2009) Article DOI: 10.1021/jm900628z BindingDB Entry DOI: 10.7270/Q2668DB1
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50311999 ((S)-hexyl 5-(2-(1-benzylpiperidin-4-yl)ethylamino)...) Show SMILES CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c1cc(Br)cs1 |r| Show InChI InChI=1S/C30H42BrN3O4S/c1-2-3-4-8-19-38-30(37)26(33-29(36)27-20-25(31)22-39-27)11-12-28(35)32-16-13-23-14-17-34(18-15-23)21-24-9-6-5-7-10-24/h5-7,9-10,20,22-23,26H,2-4,8,11-19,21H2,1H3,(H,32,35)(H,33,36)/t26-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Quimica Medica (CSIC) Curated by ChEMBL					Assay Description Inhibition of BuChE in horse serum by Ellman method				J Med Chem 52: 7249-57 (2009) Article DOI: 10.1021/jm900628z BindingDB Entry DOI: 10.7270/Q2668DB1
					More data for this Ligand-Target Pair