BDBM50005762 (+/-)-Heptyl-carbamic acid 3a-methyl-1-propyl-1,2,3,3a,8,8a-hexahydro-1-aza-cyclopenta[a]inden-5-yl ester::CHEMBL33642

SMILES: CCCCCCCNC(=O)Oc1ccc2CC3N(CCC)CC[C@@]3(C)c2c1

InChI Key: InChIKey=QSCQOXMIFSONAX-YANBTOMASA-N

Data: 1 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 1 hit for monomerid = 50005762   

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))	BDBM50005762 ((+/-)-Heptyl-carbamic acid 3a-methyl-1-propyl-1,2,...) Show SMILES CCCCCCCNC(=O)Oc1ccc2CC3N(CCC)CC[C@@]3(C)c2c1 Show InChI InChI=1S/C23H36N2O2/c1-4-6-7-8-9-13-24-22(26)27-19-11-10-18-16-21-23(3,20(18)17-19)12-15-25(21)14-5-2/h10-11,17,21H,4-9,12-16H2,1-3H3,(H,24,26)/t21?,23-/m0/s1	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	93	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description In vitro inhibitory activity against human Acetylcholinesterase				J Med Chem 35: 1429-34 (1992) BindingDB Entry DOI: 10.7270/Q2RN38GQ
					More data for this Ligand-Target Pair