BDBM50200961 CHEMBL384519::ethyl 2-amino-6-ethyl-4-(1-cyano-2-ethoxy-2-oxoethyl)-4Hchromene-3-carboxylate

SMILES: CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(CC)cc12

InChI Key: InChIKey=ADECWTUUPUBONY-UHFFFAOYSA-N

Data: 3 KI

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 = 50200961   

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
BCL-W (Homo sapiens (Human))	BDBM50200961 (CHEMBL384519 | ethyl 2-amino-6-ethyl-4-(1-cyano-2-...) Show SMILES CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(CC)cc12 Show InChI InChI=1S/C19H22N2O5/c1-4-11-7-8-14-12(9-11)15(13(10-20)18(22)24-5-2)16(17(21)26-14)19(23)25-6-3/h7-9,13,15-16,21H,4-6H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.21E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity to Bclw by FP assay				J Med Chem 49: 7731-9 (2006) Article DOI: 10.1021/jm060968r BindingDB Entry DOI: 10.7270/Q2PR7VMG
					More data for this Ligand-Target Pair
Bcl-2-like protein 1 (Homo sapiens (Human))	BDBM50200961 (CHEMBL384519 | ethyl 2-amino-6-ethyl-4-(1-cyano-2-...) Show SMILES CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(CC)cc12 Show InChI InChI=1S/C19H22N2O5/c1-4-11-7-8-14-12(9-11)15(13(10-20)18(22)24-5-2)16(17(21)26-14)19(23)25-6-3/h7-9,13,15-16,21H,4-6H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.35E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity to BclXL by FP assay				J Med Chem 49: 7731-9 (2006) Article DOI: 10.1021/jm060968r BindingDB Entry DOI: 10.7270/Q2PR7VMG
					More data for this Ligand-Target Pair
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM50200961 (CHEMBL384519 | ethyl 2-amino-6-ethyl-4-(1-cyano-2-...) Show SMILES CCOC(=O)C(C#N)C1C(C(=O)OCC)C(=N)Oc2ccc(CC)cc12 Show InChI InChI=1S/C19H22N2O5/c1-4-11-7-8-14-12(9-11)15(13(10-20)18(22)24-5-2)16(17(21)26-14)19(23)25-6-3/h7-9,13,15-16,21H,4-6H2,1-3H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.10E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity to Bcl2 by FP assay				J Med Chem 49: 7731-9 (2006) Article DOI: 10.1021/jm060968r BindingDB Entry DOI: 10.7270/Q2PR7VMG
					More data for this Ligand-Target Pair