BDBM50110252 CHEMBL3605419

SMILES: CN(C)CCC[C@]1(OCc2cc(ccc12)-c1nnc([nH]1)-c1cccc(C)c1)c1ccc(F)cc1

InChI Key:

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50110252   

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))	BDBM50110252 (CHEMBL3605419) Show SMILES CN(C)CCC[C@]1(OCc2cc(ccc12)-c1nnc([nH]1)-c1cccc(C)c1)c1ccc(F)cc1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of the Punjab Curated by ChEMBL					Assay Description Inhibition of AChE (unknown origin) using acetylthiocholine iodide as substrate preincubated for 30 mins before substrate addition measured after 30 ...				Bioorg Med Chem 23: 6014-24 (2015) BindingDB Entry DOI: 10.7270/Q2TT4SQS
					More data for this Ligand-Target Pair
Cholinesterase (Homo sapiens (Human))	BDBM50110252 (CHEMBL3605419) Show SMILES CN(C)CCC[C@]1(OCc2cc(ccc12)-c1nnc([nH]1)-c1cccc(C)c1)c1ccc(F)cc1 |r| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of the Punjab Curated by ChEMBL					Assay Description Inhibition of BChE (unknown origin) using butyrylthiocholine chloride as substrate preincubated for 30 mins before substrate addition measured after ...				Bioorg Med Chem 23: 6014-24 (2015) BindingDB Entry DOI: 10.7270/Q2TT4SQS
					More data for this Ligand-Target Pair