BDBM50005767 (+/-)-(1-Phenyl-ethyl)-carbamic acid 1-ethyl-3a-methyl-1,2,3,3a,8,8a-hexahydro-1-aza-cyclopenta[a]inden-5-yl ester::CHEMBL33173

SMILES: CCN1CC[C@]2(C)C1Cc1ccc(OC(=O)N[C@@H](C)c3ccccc3)cc21

InChI Key: InChIKey=VONJUQXHNPNBDU-NFGFVTGESA-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 = 50005767   

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))	BDBM50005767 ((+/-)-(1-Phenyl-ethyl)-carbamic acid 1-ethyl-3a-me...) Show SMILES CCN1CC[C@]2(C)C1Cc1ccc(OC(=O)N[C@@H](C)c3ccccc3)cc21 Show InChI InChI=1S/C23H28N2O2/c1-4-25-13-12-23(3)20-15-19(11-10-18(20)14-21(23)25)27-22(26)24-16(2)17-8-6-5-7-9-17/h5-11,15-16,21H,4,12-14H2,1-3H3,(H,24,26)/t16-,21?,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	1.33E+3	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