BDBM50211238 9-(4-Pyrrolidinobutyramido)-1-azabenzanthrone::CHEMBL246912::N-(7-oxo-7H-1-aza-benzo[de]anthracen-9-yl)-4-pyrrolidin-1-yl-butyramide

SMILES: O=C(CCCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13

InChI Key: InChIKey=GLDCKTVHDJXJLO-UHFFFAOYSA-N

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 = 50211238   

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
Butyrylcholinesterase (BChE) (Equus caballus (Horse))	BDBM50211238 (9-(4-Pyrrolidinobutyramido)-1-azabenzanthrone | CH...) Show SMILES O=C(CCCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C24H23N3O2/c28-21(7-4-14-27-12-1-2-13-27)26-17-8-9-18-20(15-17)24(29)19-6-3-5-16-10-11-25-23(18)22(16)19/h3,5-6,8-11,15H,1-2,4,7,12-14H2,(H,26,28)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-Sen University Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE				Bioorg Med Chem Lett 17: 3765-8 (2007) Article DOI: 10.1016/j.bmcl.2007.04.015 BindingDB Entry DOI: 10.7270/Q28C9X2C
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50211238 (9-(4-Pyrrolidinobutyramido)-1-azabenzanthrone | CH...) Show SMILES O=C(CCCN1CCCC1)Nc1ccc-2c(c1)C(=O)c1cccc3ccnc-2c13 Show InChI InChI=1S/C24H23N3O2/c28-21(7-4-14-27-12-1-2-13-27)26-17-8-9-18-20(15-17)24(29)19-6-3-5-16-10-11-25-23(18)22(16)19/h3,5-6,8-11,15H,1-2,4,7,12-14H2,(H,26,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12.1	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-Sen University Curated by ChEMBL					Assay Description Inhibition of electric eel AChE				Bioorg Med Chem Lett 17: 3765-8 (2007) Article DOI: 10.1016/j.bmcl.2007.04.015 BindingDB Entry DOI: 10.7270/Q28C9X2C
					More data for this Ligand-Target Pair