BDBM50409112 CHEMBL109084

SMILES: Cc1c(C)c(=O)oc2cc(OCCc3ccccc3)ccc12

InChI Key: InChIKey=HPHRYPTWOLJCAG-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50409112   

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
Monoamine Oxidase Type B (MAO-B) (Rattus norvegicus (rat))	BDBM50409112 (CHEMBL109084) Show SMILES Cc1c(C)c(=O)oc2cc(OCCc3ccccc3)ccc12 Show InChI InChI=1S/C19H18O3/c1-13-14(2)19(20)22-18-12-16(8-9-17(13)18)21-11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.60	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lausanne Curated by ChEMBL					Assay Description Inhibitory activity against monoamine oxidase B				J Med Chem 44: 3195-8 (2001) BindingDB Entry DOI: 10.7270/Q2HQ417K
					More data for this Ligand-Target Pair
Monoamine Oxidase Type B (MAO-B) (Rattus norvegicus (rat))	BDBM50409112 (CHEMBL109084) Show SMILES Cc1c(C)c(=O)oc2cc(OCCc3ccccc3)ccc12 Show InChI InChI=1S/C19H18O3/c1-13-14(2)19(20)22-18-12-16(8-9-17(13)18)21-11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.62	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lausanne Curated by ChEMBL					Assay Description Inhibitory effect on Monoamine oxidase B, SD on IC50 values < 10%				J Med Chem 43: 4747-58 (2000) BindingDB Entry DOI: 10.7270/Q20K29RT
					More data for this Ligand-Target Pair
Monoamine oxidase (Rattus norvegicus (rat))	BDBM50409112 (CHEMBL109084) Show SMILES Cc1c(C)c(=O)oc2cc(OCCc3ccccc3)ccc12 Show InChI InChI=1S/C19H18O3/c1-13-14(2)19(20)22-18-12-16(8-9-17(13)18)21-11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lausanne Curated by ChEMBL					Assay Description Inhibitory effect on monoamine oxidase A, SD on IC50 values < 10%				J Med Chem 43: 4747-58 (2000) BindingDB Entry DOI: 10.7270/Q20K29RT
					More data for this Ligand-Target Pair
Monoamine oxidase (Rattus norvegicus (rat))	BDBM50409112 (CHEMBL109084) Show SMILES Cc1c(C)c(=O)oc2cc(OCCc3ccccc3)ccc12 Show InChI InChI=1S/C19H18O3/c1-13-14(2)19(20)22-18-12-16(8-9-17(13)18)21-11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lausanne Curated by ChEMBL					Assay Description Inhibitory activity against monoamine oxidase A				J Med Chem 44: 3195-8 (2001) BindingDB Entry DOI: 10.7270/Q2HQ417K
					More data for this Ligand-Target Pair