null

SMILES: O=C(NCCNc1c2CCCCc2nc2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1

InChI Key: InChIKey=XDSJIKQHXRQOIP-KNTRCKAVSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50510841   

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 (Homo sapiens (Human))	BDBM50510841 (CHEMBL4522757) Show SMILES O=C(NCCNc1c2CCCCc2nc2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C31H31N3O2/c35-30(19-16-23-14-17-25(18-15-23)36-22-24-8-2-1-3-9-24)32-20-21-33-31-26-10-4-6-12-28(26)34-29-13-7-5-11-27(29)31/h1-4,6,8-10,12,14-19H,5,7,11,13,20-22H2,(H,32,35)(H,33,34)/b19-16+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of human acetylcholinesterase using acetylthiocholine as substrate pretreated followed by substrate addition and measured after 15 mins by...				Bioorg Med Chem 27: 895-930 (2019) Article DOI: 10.1016/j.bmc.2019.01.025
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50510841 (CHEMBL4522757) Show SMILES O=C(NCCNc1c2CCCCc2nc2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C31H31N3O2/c35-30(19-16-23-14-17-25(18-15-23)36-22-24-8-2-1-3-9-24)32-20-21-33-31-26-10-4-6-12-28(26)34-29-13-7-5-11-27(29)31/h1-4,6,8-10,12,14-19H,5,7,11,13,20-22H2,(H,32,35)(H,33,34)/b19-16+	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate pretreated followed by substrate addition and measured after 2 mins by El...				Bioorg Med Chem 27: 895-930 (2019) Article DOI: 10.1016/j.bmc.2019.01.025
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50510841 (CHEMBL4522757) Show SMILES O=C(NCCNc1c2CCCCc2nc2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C31H31N3O2/c35-30(19-16-23-14-17-25(18-15-23)36-22-24-8-2-1-3-9-24)32-20-21-33-31-26-10-4-6-12-28(26)34-29-13-7-5-11-27(29)31/h1-4,6,8-10,12,14-19H,5,7,11,13,20-22H2,(H,32,35)(H,33,34)/b19-16+	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate pretreated followed by substrate addition and measured after 2 mins by ...				Bioorg Med Chem 27: 895-930 (2019) Article DOI: 10.1016/j.bmc.2019.01.025
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50510841 (CHEMBL4522757) Show SMILES O=C(NCCNc1c2CCCCc2nc2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C31H31N3O2/c35-30(19-16-23-14-17-25(18-15-23)36-22-24-8-2-1-3-9-24)32-20-21-33-31-26-10-4-6-12-28(26)34-29-13-7-5-11-27(29)31/h1-4,6,8-10,12,14-19H,5,7,11,13,20-22H2,(H,32,35)(H,33,34)/b19-16+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	86	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of human butyrylcholinesterase using butyrylthiocholine iodide as substrate pretreated followed by substrate addition and measured after 1...				Bioorg Med Chem 27: 895-930 (2019) Article DOI: 10.1016/j.bmc.2019.01.025
					More data for this Ligand-Target Pair