BDBM50005765 (+/-)-Hexyl-carbamic acid 1-propyl-1,2,3,3a,8,8a-hexahydro-1-aza-cyclopenta[a]inden-5-yl ester::(-)Hexyl-carbamic acid 1-propyl-1,2,3,3a,8,8a-hexahydro-1-aza-cyclopenta[a]inden-5-yl ester::CHEMBL32543

SMILES: CCCCCCNC(=O)Oc1ccc2CC3[C@@H](CCN3CCC)c2c1

InChI Key: InChIKey=LKLDMKAWSUSARS-LROBGIAVSA-N

Data: 3 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 3 hits for monomerid = 50005765   

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))	BDBM50005765 ((+/-)-Hexyl-carbamic acid 1-propyl-1,2,3,3a,8,8a-h...) Show SMILES CCCCCCNC(=O)Oc1ccc2CC3[C@@H](CCN3CCC)c2c1 Show InChI InChI=1S/C21H32N2O2/c1-3-5-6-7-11-22-21(24)25-17-9-8-16-14-20-18(19(16)15-17)10-13-23(20)12-4-2/h8-9,15,18,20H,3-7,10-14H2,1-2H3,(H,22,24)/t18-,20?/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	518	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 AchE (Acetylcholinesterase)				J Med Chem 35: 1429-34 (1992) BindingDB Entry DOI: 10.7270/Q2RN38GQ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50005765 ((+/-)-Hexyl-carbamic acid 1-propyl-1,2,3,3a,8,8a-h...) Show SMILES CCCCCCNC(=O)Oc1ccc2CC3[C@@H](CCN3CCC)c2c1 Show InChI InChI=1S/C21H32N2O2/c1-3-5-6-7-11-22-21(24)25-17-9-8-16-14-20-18(19(16)15-17)10-13-23(20)12-4-2/h8-9,15,18,20H,3-7,10-14H2,1-2H3,(H,22,24)/t18-,20?/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	546	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 AchE (Acetylcholinesterase)				J Med Chem 35: 1429-34 (1992) BindingDB Entry DOI: 10.7270/Q2RN38GQ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50005765 ((+/-)-Hexyl-carbamic acid 1-propyl-1,2,3,3a,8,8a-h...) Show SMILES CCCCCCNC(=O)Oc1ccc2CC3[C@@H](CCN3CCC)c2c1 Show InChI InChI=1S/C21H32N2O2/c1-3-5-6-7-11-22-21(24)25-17-9-8-16-14-20-18(19(16)15-17)10-13-23(20)12-4-2/h8-9,15,18,20H,3-7,10-14H2,1-2H3,(H,22,24)/t18-,20?/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	546	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University Curated by ChEMBL					Assay Description Inhibition of AChE				Eur J Med Chem 45: 1167-72 (2010) Article DOI: 10.1016/j.ejmech.2009.12.038 BindingDB Entry DOI: 10.7270/Q25H7GFM
					More data for this Ligand-Target Pair