Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 231.2 BDBM50027638

Wt: 231.2 BDBM50027645

Wt: 231.2 BDBM50027647

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50027638 (1-(2-Methyl-acryloyl)-2,3-dihydro-1H-indole-2-carb...) Show SMILES CC(=C)C(=O)N1[C@@H](Cc2ccccc12)C(O)=O Show InChI InChI=1S/C13H13NO3/c1-8(2)12(15)14-10-6-4-3-5-9(10)7-11(14)13(16)17/h3-6,11H,1,7H2,2H3,(H,16,17)/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against Angiotensin I converting enzyme				J Med Chem 26: 394-403 (1983) BindingDB Entry DOI: 10.7270/Q2T15473
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50027645 (1-(2-Methyl-acryloyl)-2,3-dihydro-1H-indole-2-carb...) Show SMILES CC(=C)C(=O)N1[C@H](Cc2ccccc12)C(O)=O Show InChI InChI=1S/C13H13NO3/c1-8(2)12(15)14-10-6-4-3-5-9(10)7-11(14)13(16)17/h3-6,11H,1,7H2,2H3,(H,16,17)/t11-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against Angiotensin I converting enzyme				J Med Chem 26: 394-403 (1983) BindingDB Entry DOI: 10.7270/Q2T15473
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50027647 (1-(2-Methyl-acryloyl)-2,3-dihydro-1H-indole-2-carb...) Show SMILES CC(=C)C(=O)N1C(Cc2ccccc12)C(O)=O Show InChI InChI=1S/C13H13NO3/c1-8(2)12(15)14-10-6-4-3-5-9(10)7-11(14)13(16)17/h3-6,11H,1,7H2,2H3,(H,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against Angiotensin I converting enzyme				J Med Chem 26: 394-403 (1983) BindingDB Entry DOI: 10.7270/Q2T15473
					More data for this Ligand-Target Pair